A0A060WJK1_ONCMY Loading...

Polycomb group RING finger protein 1

AlphaFold DB , UniProt , Accession A0A060WJK1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 262 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	45.6	Very low	244 Å²	244	109.6 Å²	109.6	100%	1.202	62%	0.62	S	S	*	*				0	111.2	0	-72.1	-173	167.8	0	0	106.9	E3	M1-E3 PolarHBondContact O-N 3.13Å
2	A	40.6	Very low	46.4	Very low	98 Å²	98	113 Å²	113	81%	0.81	62%	0.615	S	S	*	*			trans	-70.6	115.1	-170	0	0	0	0	0	110.8	Q4	A2-Q4 PolarHBondContact O-N 2.88Å; A2-Q4 VanDerWaalsContact O-N 3.09Å
3	E	45.8	Very low	46.8	Very low	193 Å²	193	110.5 Å²	110.5	90%	0.902	60%	0.6	S	S	*	*			trans	-59	108.9	168.1	-71.9	-177.7	145.5	0	0	108.6	M1 G5	M1-E3 PolarHBondContact O-N 3.13Å; E3-G5 PolarHBondContact O-N 3Å; E3-G5 VanDerWaalsContact O-N 3.1Å
4	Q	45.6	Very low	47	Very low	95 Å²	95	110.1 Å²	110.1	44%	0.444	59%	0.586	S	S	.	*			trans	-69.9	108.9	173.2	-68.7	-172	2.3	0	0	107.9	A2 A8	A2-Q4 PolarHBondContact O-N 2.88Å; A2-Q4 VanDerWaalsContact O-N 3.09Å; Q4-A8 HydrophobicContact CB-CB 4.03Å
5	G	50.8	Low	47.3	Very low	38 Å²	38	109.1 Å²	109.1	39%	0.392	58%	0.581	S	S	.	*			trans	-55.8	163	-178.7	0	0	0	0	0	113.6	E3 M7 A8	E3-G5 PolarHBondContact O-N 3Å; E3-G5 VanDerWaalsContact O-N 3.1Å; G5-M7 PolarHBondContact O-N 2.82Å; G5-A8 WeakPolarHBondContact O-CB 3.35Å; G5-A8 PolarHBondContact O-N 3.01Å
6	P	53.1	Low	47.9	Very low	117 Å²	117	110.2 Å²	110.2	76%	0.76	58%	0.581	S	S	*	*	H	α-helix	trans	-54	-26.4	-174.2	17.8	-30.5	0	0	0	113.9	A10	P6-A10 WeakPolarHBondContact O-CB 3.49Å; P6-A10 PolarHBondContact O-N 2.98Å
7	M	38.3	Very low	48.2	Very low	156 Å²	156	106.5 Å²	106.5	77%	0.768	56%	0.562	S	S	*	*	H	α-helix	trans	-70.2	-35.5	177.2	-151.3	136.9	169.3	0	0	113.1	G5 A10 M11	G5-M7 PolarHBondContact O-N 2.82Å; M7-A10 PolarHBondContact O-N 3.35Å; M7-M11 WeakPolarHBondContact O-CB 3.38Å; M7-M11 VanDerWaalsContact O-CG 3.27Å; M7-M11 WeakPolarHBondContact O-CG 3.29Å; M7-M11 PolarHBondContact O-N 3.13Å
8	A	45.4	Very low	48.4	Very low	37 Å²	37	105.1 Å²	105.1	31%	0.306	55%	0.551	S	S	.	*	H	α-helix	trans	-71.5	-36.7	177.5	0	0	0	0	0	111.8	Q4 G5 M11 R12	Q4-A8 HydrophobicContact CB-CB 4.03Å; G5-A8 WeakPolarHBondContact O-CB 3.35Å; G5-A8 PolarHBondContact O-N 3.01Å; A8-M11 PolarHBondContact O-N 2.88Å; A8-R12 PolarHBondContact O-N 2.93Å
9	I	52.9	Low	48.6	Very low	93 Å²	93	102.9 Å²	102.9	48%	0.477	55%	0.546	S	S	.	.	H	α-helix	trans	-65.9	-44.9	173.4	-62.8	172.8	0	0	0	110.2	M11 R12 L13	I9-M11 VanDerWaalsContact C-N 3.34Å; I9-M11 PolarHBondContact O-N 3.03Å; I9-R12 PolarHBondContact O-N 3.28Å; I9-L13 HydrophobicContact CG2-CD1 4Å; I9-L13 PolarHBondContact O-N 3.2Å
10	A	44	Very low	48.8	Very low	27 Å²	27	102.2 Å²	102.2	22%	0.223	55%	0.545	C	S	.	.	H	α-helix	trans	-62.3	-38.4	175.8	0	0	0	0	0	112.6	P6 M7 R14 F244	P6-A10 WeakPolarHBondContact O-CB 3.49Å; P6-A10 PolarHBondContact O-N 2.98Å; M7-A10 PolarHBondContact O-N 3.35Å; A10-R14 VanDerWaalsContact O-CB 3.24Å; A10-R14 WeakPolarHBondContact O-CB 3.31Å; A10-R14 PolarHBondContact O-N 2.9Å; A10-F244 HydrophobicContact CB-CD1 4.42Å; A10-F244 HydrophobicContact CB-CE1 4.1Å
11	M	46.2	Very low	48.8	Very low	108 Å²	108	99.1 Å²	99.1	53%	0.532	53%	0.526	S	S	.	.	H	α-helix	trans	-68.5	-39.3	175.4	-74.1	176.9	85	0	0	112.5	M7 A8 I9 R14 N15	M7-M11 WeakPolarHBondContact O-CB 3.38Å; M7-M11 VanDerWaalsContact O-CG 3.27Å; M7-M11 WeakPolarHBondContact O-CG 3.29Å; M7-M11 PolarHBondContact O-N 3.13Å; A8-M11 PolarHBondContact O-N 2.88Å; I9-M11 VanDerWaalsContact C-N 3.34Å; I9-M11 PolarHBondContact O-N 3.03Å; M11-R14 PolarHBondContact O-N 3.23Å; M11-N15 WeakPolarHBondContact O-CB 3.32Å; M11-N15 PolarHBondContact O-N 2.68Å; M11-N15 PolarHBondContact O-ND2 2.86Å
12	R	56	Low	49.3	Very low	150 Å²	150	95.6 Å²	95.6	57%	0.566	50%	0.504	S	S	*	.	H	α-helix	trans	-63.2	-47.1	173.4	-84.7	-177.3	179.5	168.7	-0.7	112.1	A8 I9 R14 N15 Q16	A8-R12 PolarHBondContact O-N 2.93Å; I9-R12 PolarHBondContact O-N 3.28Å; R12-R14 VanDerWaalsContact C-N 3.33Å; R12-R14 PolarHBondContact O-N 2.99Å; R12-N15 PolarHBondContact O-N 3.25Å; R12-Q16 WeakPolarHBondContact O-CB 3.3Å; R12-Q16 PolarHBondContact O-N 2.66Å
13	L	51.5	Low	49.5	Very low	81 Å²	81	97.6 Å²	97.6	42%	0.424	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-42.8	175	-81.5	159.9	0	0	0	111.1	I9 N15 L17	I9-L13 HydrophobicContact CG2-CD1 4Å; I9-L13 PolarHBondContact O-N 3.2Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 3.21Å; L13-L17 WeakPolarHBondContact O-CB 3.25Å; L13-L17 WeakPolarHBondContact O-CD1 3.16Å; L13-L17 WeakPolarHBondContact O-CG 3.4Å; L13-L17 PolarHBondContact O-N 3.09Å
14	R	48.9	Very low	49.6	Very low	105 Å²	105	89.7 Å²	89.7	40%	0.396	47%	0.465	S	S	.	.	H	α-helix	trans	-58.9	-43.7	174.2	179.5	-175.6	-74.1	-172.5	-4.5	111.8	A10 M11 R12 Q18 S241	A10-R14 VanDerWaalsContact O-CB 3.24Å; A10-R14 WeakPolarHBondContact O-CB 3.31Å; A10-R14 PolarHBondContact O-N 2.9Å; M11-R14 PolarHBondContact O-N 3.23Å; R12-R14 VanDerWaalsContact C-N 3.33Å; R12-R14 PolarHBondContact O-N 2.99Å; R14-Q18 VanDerWaalsContact O-CB 3.31Å; R14-Q18 WeakPolarHBondContact O-CB 3.43Å; R14-Q18 WeakPolarHBondContact O-CG 3.38Å; R14-Q18 PolarHBondContact O-N 3.1Å; R14-S241 PolarHBondContact NH2-O 3.43Å
15	N	51.3	Low	49.8	Very low	95 Å²	95	90.5 Å²	90.5	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-72.7	-41.8	-178.6	-71	-13.1	0	0	0	112.3	M11 R12 L13 Q18 S19	M11-N15 WeakPolarHBondContact O-CB 3.32Å; M11-N15 PolarHBondContact O-N 2.68Å; M11-N15 PolarHBondContact O-ND2 2.86Å; R12-N15 PolarHBondContact O-N 3.25Å; L13-N15 VanDerWaalsContact C-N 3.34Å; L13-N15 PolarHBondContact O-N 3.21Å; N15-Q18 PolarHBondContact O-N 2.95Å; N15-S19 PolarHBondContact O-N 2.73Å
16	Q	57.1	Low	49.6	Very low	126 Å²	126	93 Å²	93	59%	0.589	48%	0.482	S	S	*	.	H	α-helix	trans	-62.7	-42.6	172	-86.9	-178.1	-34.3	0	0	111.5	R12 Q18 S19 V20	R12-Q16 WeakPolarHBondContact O-CB 3.3Å; R12-Q16 PolarHBondContact O-N 2.66Å; Q16-Q18 VanDerWaalsContact C-N 3.35Å; Q16-S19 PolarHBondContact O-N 2.93Å; Q16-S19 PolarHBondContact O-OG 3.25Å; Q16-V20 WeakPolarHBondContact O-CB 3.34Å; Q16-V20 VanDerWaalsContact O-CG2 3.24Å; Q16-V20 WeakPolarHBondContact O-CG2 3.49Å; Q16-V20 PolarHBondContact O-N 3.24Å
17	L	54	Low	49.6	Very low	48 Å²	48	89.6 Å²	89.6	25%	0.251	45%	0.454	S	S	.	.	H	α-helix	trans	-67.7	-37.9	175.9	-72.4	171.3	0	0	0	110.8	L13 S19 V20 Y21 L240	L13-L17 WeakPolarHBondContact O-CB 3.25Å; L13-L17 WeakPolarHBondContact O-CD1 3.16Å; L13-L17 WeakPolarHBondContact O-CG 3.4Å; L13-L17 PolarHBondContact O-N 3.09Å; L17-S19 PolarHBondContact O-N 2.9Å; L17-V20 PolarHBondContact O-N 3.1Å; L17-Y21 VanDerWaalsContact C-CD2 3.45Å; L17-Y21 HydrophobicContact CB-CD2 3.93Å; L17-Y21 HydrophobicContact CB-CE2 3.63Å; L17-Y21 HydrophobicContact CD2-CE2 4.1Å; L17-Y21 HydrophobicContact CG-CE2 4.33Å; L17-Y21 WeakPolarHBondContact O-CB 3.44Å; L17-Y21 WeakPolarHBondContact O-CD2 3.37Å; L17-Y21 PolarHBondContact O-N 2.99Å; L17-L240 HydrophobicContact CD1-CD1 3.51Å
18	Q	51.5	Low	50.2	Low	80 Å²	80	86.6 Å²	86.6	37%	0.374	44%	0.441	S	S	.	.	H	α-helix	trans	-63.3	-37.3	174	-85.6	-176.8	-4.4	0	0	113.2	R14 N15 Q16 Y21 K22	R14-Q18 VanDerWaalsContact O-CB 3.31Å; R14-Q18 WeakPolarHBondContact O-CB 3.43Å; R14-Q18 WeakPolarHBondContact O-CG 3.38Å; R14-Q18 PolarHBondContact O-N 3.1Å; N15-Q18 PolarHBondContact O-N 2.95Å; Q16-Q18 VanDerWaalsContact C-N 3.35Å; Q18-Y21 PolarHBondContact O-N 3.31Å; Q18-K22 WeakPolarHBondContact O-CB 3.31Å; Q18-K22 WeakPolarHBondContact O-CG 3.23Å; Q18-K22 PolarHBondContact O-N 2.9Å
19	S	51.7	Low	50.5	Low	64 Å²	64	92.2 Å²	92.2	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-69.7	-43.7	175.1	63.4	0	0	0	0	111.6	N15 Q16 L17 Y21 K22 L23	N15-S19 PolarHBondContact O-N 2.73Å; Q16-S19 PolarHBondContact O-N 2.93Å; Q16-S19 PolarHBondContact O-OG 3.25Å; L17-S19 PolarHBondContact O-N 2.9Å; S19-Y21 VanDerWaalsContact C-N 3.29Å; S19-Y21 PolarHBondContact O-N 3.19Å; S19-K22 PolarHBondContact O-N 2.96Å; S19-L23 WeakPolarHBondContact O-CG 3.42Å; S19-L23 PolarHBondContact O-N 3.17Å
20	V	51.8	Low	50.9	Low	88 Å²	88	95.4 Å²	95.4	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-37.5	173.7	174.1	0	0	0	0	111.3	Q16 L17 L23 D24	Q16-V20 WeakPolarHBondContact O-CB 3.34Å; Q16-V20 VanDerWaalsContact O-CG2 3.24Å; Q16-V20 WeakPolarHBondContact O-CG2 3.49Å; Q16-V20 PolarHBondContact O-N 3.24Å; L17-V20 PolarHBondContact O-N 3.1Å; V20-L23 CarbonylContact O-C 3.52Å; V20-L23 PolarHBondContact O-N 2.93Å; V20-D24 PolarHBondContact O-N 3.19Å
21	Y	48.8	Very low	51.7	Low	38 Å²	38	101.6 Å²	101.6	15%	0.149	50%	0.499	C	S	.	.	H	α-helix	trans	-81	-22	179.4	-69.7	-41.9	0	0	0	114.6	L17 Q18 S19 L23 D24 R27 K236 L240	L17-Y21 VanDerWaalsContact C-CD2 3.45Å; L17-Y21 HydrophobicContact CB-CD2 3.93Å; L17-Y21 HydrophobicContact CB-CE2 3.63Å; L17-Y21 HydrophobicContact CD2-CE2 4.1Å; L17-Y21 HydrophobicContact CG-CE2 4.33Å; L17-Y21 WeakPolarHBondContact O-CB 3.44Å; L17-Y21 WeakPolarHBondContact O-CD2 3.37Å; L17-Y21 PolarHBondContact O-N 2.99Å; Q18-Y21 PolarHBondContact O-N 3.31Å; S19-Y21 VanDerWaalsContact C-N 3.29Å; S19-Y21 PolarHBondContact O-N 3.19Å; Y21-L23 VanDerWaalsContact C-N 3.28Å; Y21-D24 WeakPolarHBondContact O-CB 3.14Å; Y21-D24 PolarHBondContact O-N 2.81Å; Y21-R27 VanDerWaalsContact CB-NH1 3.32Å; Y21-K236 WeakPolarHBondContact OH-CD 3.34Å; Y21-K236 WeakPolarHBondContact OH-CE 3.27Å; Y21-K236 WeakPolarHBondContact OH-CG 3.14Å; Y21-L240 HydrophobicContact CE2-CD1 4.36Å
22	K	49.7	Very low	52.8	Low	170 Å²	170	101 Å²	101	74%	0.739	50%	0.501	S	S	*	.	H	α-helix	trans	-71.4	-28.2	167	-85.3	-176.1	176.1	-173.3	0	111.5	Q18 S19 D24	Q18-K22 WeakPolarHBondContact O-CB 3.31Å; Q18-K22 WeakPolarHBondContact O-CG 3.23Å; Q18-K22 PolarHBondContact O-N 2.9Å; S19-K22 PolarHBondContact O-N 2.96Å; K22-D24 VanDerWaalsContact C-N 3.33Å
23	L	45.3	Very low	53.8	Low	140 Å²	140	102 Å²	102	73%	0.733	51%	0.509	S	S	*	.	S	Bend	trans	-86.8	-2.9	173.8	-66.4	166.7	0	0	0	112.8	S19 V20 Y21 P25	S19-L23 WeakPolarHBondContact O-CG 3.42Å; S19-L23 PolarHBondContact O-N 3.17Å; V20-L23 CarbonylContact O-C 3.52Å; V20-L23 PolarHBondContact O-N 2.93Å; Y21-L23 VanDerWaalsContact C-N 3.28Å; L23-P25 WeakPolarHBondContact O-CD 3.36Å; L23-P25 VanDerWaalsContact O-N 3.1Å
24	D	48.4	Very low	55.2	Low	28 Å²	28	103.6 Å²	103.6	15%	0.15	52%	0.518	C	S	.	.			trans	-66.8	105.1	177.2	-172.1	-14.1	0	0	0	108.5	V20 Y21 K22 L26 R27	V20-D24 PolarHBondContact O-N 3.19Å; Y21-D24 WeakPolarHBondContact O-CB 3.14Å; Y21-D24 PolarHBondContact O-N 2.81Å; K22-D24 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.04Å; D24-L26 WeakPolarHBondContact OD1-CB 3.26Å; D24-L26 PolarHBondContact OD1-N 3.35Å; D24-R27 HydrophobicContact CB-CB 4.33Å; D24-R27 HydrophobicContact CB-CG 3.98Å; D24-R27 PolarHBondContact O-N 3.08Å; D24-R27 IonicContact OD2-CZ 3.89Å; D24-R27 IonicContact OD2-NE 3.32Å; D24-R27 PolarHBondContact OD2-NE 2.95Å; D24-R27 IonicContact OD2-NH2 3.7Å; D24-R27 PolarHBondContact OD2-NH2 2.92Å
25	P	48.4	Very low	57.1	Low	111 Å²	111	105.7 Å²	105.7	72%	0.721	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.9	-172.6	-18.9	33.7	0	0	0	112.5	L23 R27	L23-P25 WeakPolarHBondContact O-CD 3.36Å; L23-P25 VanDerWaalsContact O-N 3.1Å; P25-R27 VanDerWaalsContact C-N 3.32Å
26	L	47.1	Very low	58.9	Low	92 Å²	92	104 Å²	104	48%	0.482	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.8	176.9	-57.3	172	0	0	0	113.2	D24	D24-L26 PolarHBondContact O-N 3.04Å; D24-L26 WeakPolarHBondContact OD1-CB 3.26Å; D24-L26 PolarHBondContact OD1-N 3.35Å
27	R	52.2	Low	60.5	Low	44 Å²	44	106.1 Å²	106.1	17%	0.166	53%	0.527	C	S	.	.	S	Bend	trans	-110.9	-4.1	-177.4	-63.8	-173	-160.2	-170.5	3.6	114.7	Y21 D24 P25 E29 T234	Y21-R27 VanDerWaalsContact CB-NH1 3.32Å; D24-R27 HydrophobicContact CB-CB 4.33Å; D24-R27 HydrophobicContact CB-CG 3.98Å; D24-R27 PolarHBondContact O-N 3.08Å; D24-R27 IonicContact OD2-CZ 3.89Å; D24-R27 IonicContact OD2-NE 3.32Å; D24-R27 PolarHBondContact OD2-NE 2.95Å; D24-R27 IonicContact OD2-NH2 3.7Å; D24-R27 PolarHBondContact OD2-NH2 2.92Å; P25-R27 VanDerWaalsContact C-N 3.32Å; R27-E29 PolarHBondContact O-N 3.4Å; R27-T234 PolarHBondContact NH1-OG1 3.36Å
28	N	51.2	Low	62.2	Low	94 Å²	94	108.8 Å²	108.8	50%	0.503	54%	0.541	S	S	.	.			trans	-71.4	116.3	168.9	-85.1	-3.1	0	0	0	108.3	E30	N28-E30 PolarHBondContact O-N 3.1Å
29	E	53.3	Low	64.2	Low	155 Å²	155	106.9 Å²	106.9	72%	0.724	53%	0.534	S	S	*	.	S	Bend	trans	-65.3	-17.1	170.9	-70	-171.1	157.8	0	0	111.6	R27 H232	R27-E29 PolarHBondContact O-N 3.4Å; E29-H232 IonicContact OE1-CE1 3.34Å; E29-H232 IonicContact OE1-CG 2.85Å; E29-H232 IonicContact OE1-ND1 3.99Å; E29-H232 PolarHBondContact OE1-ND1 3.41Å
30	E	60.3	Low	66.1	Low	159 Å²	159	106.2 Å²	106.2	74%	0.743	53%	0.525	S	S	*	.	S	Bend	trans	-82.1	120	174.5	-66.7	-176.5	169.1	0	0	110.6	N28 V32	N28-E30 PolarHBondContact O-N 3.1Å; E30-V32 PolarHBondContact O-N 3.06Å
31	E	60.8	Low	68.1	Low	158 Å²	158	109.4 Å²	109.4	74%	0.738	53%	0.534	S	S	*	.			trans	-59.6	102.5	168.8	-171	-179.4	-145.1	0	0	108.8	K33	E31-K33 PolarHBondContact O-N 3.43Å; E31-K33 VanDerWaalsContact O-N 3.1Å; E31-K33 VanDerWaalsContact OE2-CE 3.29Å; E31-K33 WeakPolarHBondContact OE2-CE 3.46Å; E31-K33 IonicContact OE2-NZ 2.98Å
32	V	69.4	Low	70.2	Confident	95 Å²	95	113 Å²	113	58%	0.576	55%	0.552	S	S	*	*			trans	-72.7	106	178.9	-174	0	0	0	0	108.5	E30 L34	E30-V32 PolarHBondContact O-N 3.06Å; V32-L34 HydrophobicContact CG1-CD2 3.83Å; V32-L34 HydrophobicContact CG1-CG 3.94Å; V32-L34 PolarHBondContact O-N 3.22Å
33	K	76.9	Confident	72.4	Confident	171 Å²	171	105.1 Å²	105.1	74%	0.743	52%	0.518	S	S	*	.			trans	-88	106	174.7	-66.9	-179	-178.2	176.8	0	109.3	E31	E31-K33 PolarHBondContact O-N 3.43Å; E31-K33 VanDerWaalsContact O-N 3.1Å; E31-K33 VanDerWaalsContact OE2-CE 3.29Å; E31-K33 WeakPolarHBondContact OE2-CE 3.46Å; E31-K33 IonicContact OE2-NZ 2.98Å
34	L	81.3	Confident	74.9	Confident	115 Å²	115	100.5 Å²	100.5	60%	0.602	50%	0.495	S	S	*	.			trans	-100.3	139.9	173.9	-60.8	176.3	0	0	0	109.9	V32	V32-L34 HydrophobicContact CG1-CD2 3.83Å; V32-L34 HydrophobicContact CG1-CG 3.94Å; V32-L34 PolarHBondContact O-N 3.22Å
35	K	88.8	Confident	77.3	Confident	148 Å²	148	99.1 Å²	99.1	64%	0.643	49%	0.488	S	S	*	.			trans	-81.6	129.1	169.1	-61.1	174.3	-179.2	170.4	0	107.9	K37 D38	K35-K37 PolarHBondContact O-N 2.97Å; K35-K37 VanDerWaalsContact O-N 3.1Å; K35-D38 WeakPolarHBondContact CB-OD2 3.43Å; K35-D38 WeakPolarHBondContact O-CB 3.43Å; K35-D38 PolarHBondContact O-N 3.41Å
36	I	88.8	Confident	79.5	Confident	59 Å²	59	101.3 Å²	101.3	30%	0.303	48%	0.483	S	S	.	.	H	α-helix	trans	-55.7	-32.8	178.3	-64.6	173.4	0	0	0	111.6	D38 L39 N40 Y51	I36-D38 PolarHBondContact O-N 3.46Å; I36-L39 WeakPolarHBondContact O-CA 3.47Å; I36-L39 WeakPolarHBondContact O-CB 3.48Å; I36-L39 PolarHBondContact O-N 3.26Å; I36-N40 PolarHBondContact O-N 2.88Å; I36-N40 VanDerWaalsContact O-N 3.14Å; I36-N40 PolarHBondContact O-OD1 2.76Å; I36-Y51 HydrophobicContact CG2-CE1 4.45Å; I36-Y51 VanDerWaalsContact CG2-OH 3.31Å; I36-Y51 WeakPolarHBondContact CG2-OH 3.37Å
37	K	90.3	Very high	81.9	Confident	171 Å²	171	99.8 Å²	99.8	74%	0.743	48%	0.475	S	S	*	.	H	α-helix	trans	-55.3	-35.3	176.8	-66.8	-174.1	178	-175	0	113.2	K35 L39 N40	K35-K37 PolarHBondContact O-N 2.97Å; K35-K37 VanDerWaalsContact O-N 3.1Å; K37-L39 PolarHBondContact O-N 3.37Å; K37-N40 WeakPolarHBondContact O-CB 3.34Å; K37-N40 PolarHBondContact O-N 2.86Å
38	D	91.1	Very high	84.1	Confident	104 Å²	104	100.8 Å²	100.8	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-75.2	-16.6	-178.7	-52.1	-22.6	0	0	0	111.2	K35 I36	K35-D38 WeakPolarHBondContact CB-OD2 3.43Å; K35-D38 WeakPolarHBondContact O-CB 3.43Å; K35-D38 PolarHBondContact O-N 3.41Å; I36-D38 PolarHBondContact O-N 3.46Å
39	L	92.1	Very high	86.2	Confident	41 Å²	41	100.3 Å²	100.3	22%	0.215	50%	0.497	C	S	.	.	H	α-helix	trans	-97.3	-15.7	177.2	-57.3	176.8	0	0	0	112.7	I36 K37 E41 H42 I43 L109	I36-L39 WeakPolarHBondContact O-CA 3.47Å; I36-L39 WeakPolarHBondContact O-CB 3.48Å; I36-L39 PolarHBondContact O-N 3.26Å; K37-L39 PolarHBondContact O-N 3.37Å; L39-E41 PolarHBondContact O-N 2.66Å; L39-E41 VanDerWaalsContact O-N 3.13Å; L39-H42 PolarHBondContact O-N 3.14Å; L39-I43 HydrophobicContact CB-CD1 4.19Å; L39-I43 WeakPolarHBondContact O-CG1 3.47Å; L39-I43 PolarHBondContact O-N 2.97Å; L39-L109 HydrophobicContact CD1-CD1 4.11Å; L39-L109 HydrophobicContact CD1-CD2 4.06Å
40	N	93.4	Very high	88.3	Confident	50 Å²	50	94.3 Å²	94.3	27%	0.267	48%	0.477	S	S	.	.	H	α-helix	trans	-55	-35.7	-172	-80.6	-8.4	0	0	0	112.8	I36 K37 H42 I43 V44 Y51	I36-N40 PolarHBondContact O-N 2.88Å; I36-N40 VanDerWaalsContact O-N 3.14Å; I36-N40 PolarHBondContact O-OD1 2.76Å; K37-N40 WeakPolarHBondContact O-CB 3.34Å; K37-N40 PolarHBondContact O-N 2.86Å; N40-H42 PolarHBondContact O-N 3.47Å; N40-H42 VanDerWaalsContact O-N 3.12Å; N40-I43 PolarHBondContact O-N 3.27Å; N40-V44 HydrophobicContact CB-CG2 3.97Å; N40-V44 VanDerWaalsContact O-CB 3.22Å; N40-V44 WeakPolarHBondContact O-CB 3.47Å; N40-V44 VanDerWaalsContact O-CG2 3.27Å; N40-V44 WeakPolarHBondContact O-CG2 3.32Å; N40-V44 PolarHBondContact O-N 2.95Å; N40-Y51 WeakPolarHBondContact OD1-CE1 3.46Å; N40-Y51 PolarHBondContact OD1-OH 2.84Å; N40-Y51 VanDerWaalsContact OD1-OH 3.06Å
41	E	92.5	Very high	90.1	Very high	155 Å²	155	89.8 Å²	89.8	72%	0.724	45%	0.454	S	S	*	.	H	α-helix	trans	-59.6	-22.4	177	60	174.7	-148.1	0	0	113.8	L39	L39-E41 PolarHBondContact O-N 2.66Å; L39-E41 VanDerWaalsContact O-N 3.13Å
42	H	93.6	Very high	91.9	Very high	114 Å²	114	82.7 Å²	82.7	53%	0.528	42%	0.42	S	S	.	.	H	α-helix	trans	-103	-17.5	-179.2	-56.1	-44	0	0	0	113.8	L39 N40 F52 M102	L39-H42 PolarHBondContact O-N 3.14Å; N40-H42 PolarHBondContact O-N 3.47Å; N40-H42 VanDerWaalsContact O-N 3.12Å; H42-F52 WeakPolarHBondContact O-CE2 3.46Å; H42-M102 WeakPolarHBondContact O-CE 3.18Å
43	I	95.9	Very high	93.2	Very high	4 Å²	4	79.6 Å²	79.6	2%	0.021	40%	0.4	C	S	.	.	H	α-helix	trans	-122	-0.4	-170.1	65.6	175.5	0	0	0	114.3	L39 N40 Y51 F52 M102 V106 L109 V110	L39-I43 HydrophobicContact CB-CD1 4.19Å; L39-I43 WeakPolarHBondContact O-CG1 3.47Å; L39-I43 PolarHBondContact O-N 2.97Å; N40-I43 PolarHBondContact O-N 3.27Å; I43-Y51 HydrophobicContact CD1-CD1 3.88Å; I43-Y51 HydrophobicContact CD1-CE1 3.63Å; I43-Y51 HydrophobicContact CG1-CD1 3.83Å; I43-Y51 HydrophobicContact CG1-CE1 3.83Å; I43-Y51 WeakPolarHBondContact O-CA 3.45Å; I43-F52 VanDerWaalsContact O-CD2 3.29Å; I43-F52 WeakPolarHBondContact O-CD2 3.19Å; I43-F52 PolarHBondContact O-N 3.45Å; I43-F52 VanDerWaalsContact O-N 3.15Å; I43-M102 HydrophobicContact CB-CE 4.45Å; I43-M102 HydrophobicContact CG2-CE 3.84Å; I43-V106 HydrophobicContact CB-CG2 4.03Å; I43-V106 HydrophobicContact CG2-CG2 4.11Å; I43-L109 HydrophobicContact CG2-CD1 4.23Å; I43-V110 HydrophobicContact CD1-CG2 3.83Å
44	V	97.1	Very high	94.1	Very high	42 Å²	42	75.3 Å²	75.3	26%	0.255	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-103	134.6	179.9	173.7	0	0	0	0	110.4	N40 Y46 G50 Y51	N40-V44 HydrophobicContact CB-CG2 3.97Å; N40-V44 VanDerWaalsContact O-CB 3.22Å; N40-V44 WeakPolarHBondContact O-CB 3.47Å; N40-V44 VanDerWaalsContact O-CG2 3.27Å; N40-V44 WeakPolarHBondContact O-CG2 3.32Å; N40-V44 PolarHBondContact O-N 2.95Å; V44-Y46 PolarHBondContact O-N 3.49Å; V44-G50 CarbonylContact C-O 3.5Å; V44-G50 WeakPolarHBondContact CA-O 3.34Å; V44-Y51 HydrophobicContact CG2-CD1 3.83Å; V44-Y51 HydrophobicContact CG2-CE1 3.81Å
45	C	98.1	Very high	94.8	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.357	C	S	.	.			trans	-74.4	124.9	175.1	-177.4	0	0	0	0	111.5	L47 C48 A49 G50 F52 C66	C45-L47 PolarHBondContact O-N 3.43Å; C45-C48 PolarHBondContact O-N 2.9Å; C45-A49 VanDerWaalsContact O-CA 3.27Å; C45-A49 WeakPolarHBondContact O-CA 3.41Å; C45-A49 PolarHBondContact O-N 3.22Å; C45-G50 PolarHBondContact N-O 2.88Å; C45-F52 VanDerWaalsContact CA-CE1 3.42Å; C45-F52 HydrophobicContact CB-CD1 3.73Å; C45-F52 HydrophobicContact CB-CE1 3.68Å; C45-C66 VanDerWaalsContact CB-SG 3.54Å; C45-C66 PolarHBondContact SG-N 3.32Å; C45-C66 VanDerWaalsContact SG-N 3.38Å
46	Y	96.1	Very high	95.2	Very high	156 Å²	156	63 Å²	63	61%	0.612	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-32.4	177	-176.4	-98.8	0	0	0	114	V44 P81 M82	V44-Y46 PolarHBondContact O-N 3.49Å; Y46-P81 HydrophobicContact CD1-CB 4.33Å; Y46-M82 HydrophobicContact CD1-CG 3.95Å; Y46-M82 HydrophobicContact CD2-CG 4.26Å; Y46-M82 HydrophobicContact CD2-SD 4.28Å; Y46-M82 HydrophobicContact CG-CG 3.79Å; Y46-M82 HydrophobicContact CG-SD 4.05Å
47	L	97.4	Very high	95.6	Very high	60 Å²	60	60.9 Å²	60.9	31%	0.314	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-34.4	-174.3	-71.6	172.7	0	0	0	114	C45 F65 C69 I70 Y73 P81	C45-L47 PolarHBondContact O-N 3.43Å; L47-F65 HydrophobicContact CD1-CD1 3.83Å; L47-F65 HydrophobicContact CD1-CE1 4.39Å; L47-F65 HydrophobicContact CD1-CG 4.38Å; L47-F65 HydrophobicContact CG-CD1 3.9Å; L47-F65 HydrophobicContact CG-CE1 4.23Å; L47-C69 HydrophobicContact CB-CB 3.86Å; L47-C69 HydrophobicContact CD1-CB 3.74Å; L47-C69 HydrophobicContact CG-CB 4.47Å; L47-I70 HydrophobicContact CD1-CD1 4.48Å; L47-Y73 HydrophobicContact CD2-CD2 4.09Å; L47-Y73 HydrophobicContact CD2-CG 4.44Å; L47-P81 HydrophobicContact CD1-CG 4.17Å; L47-P81 HydrophobicContact CD2-CB 3.9Å; L47-P81 HydrophobicContact CD2-CG 3.94Å; L47-P81 HydrophobicContact CG-CB 4.49Å; L47-P81 HydrophobicContact CG-CG 4.29Å
48	C	97.4	Very high	95.9	Very high	66 Å²	66	52.8 Å²	52.8	45%	0.446	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-4.5	-177.7	67.7	0	0	0	0	114	C45 G50	C45-C48 PolarHBondContact O-N 2.9Å; C48-G50 PolarHBondContact O-N 3.23Å; C48-G50 PolarHBondContact SG-N 3.03Å
49	A	96.4	Very high	96	Very high	83 Å²	83	50.3 Å²	50.3	69%	0.686	27%	0.271	S	S	*	.	S	Bend	trans	55.1	18.5	-173.6	0	0	0	0	0	114.6	C45	C45-A49 VanDerWaalsContact O-CA 3.27Å; C45-A49 WeakPolarHBondContact O-CA 3.41Å; C45-A49 PolarHBondContact O-N 3.22Å
50	G	96.6	Very high	96.1	Very high	29 Å²	29	53.6 Å²	53.6	30%	0.299	29%	0.285	S	S	.	.	S	Bend	trans	-107	167.6	173.8	0	0	0	0	0	112.3	V44 C45 C48	V44-G50 CarbonylContact C-O 3.5Å; V44-G50 WeakPolarHBondContact CA-O 3.34Å; C45-G50 PolarHBondContact N-O 2.88Å; C48-G50 PolarHBondContact O-N 3.23Å; C48-G50 PolarHBondContact SG-N 3.03Å
51	Y	97.8	Very high	96.3	Very high	65 Å²	65	52.3 Å²	52.3	26%	0.255	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-60.8	151.4	173.5	-64	-60.2	0	0	0	112	I36 N40 I43 V44 I53 V110 L113	I36-Y51 HydrophobicContact CG2-CE1 4.45Å; I36-Y51 VanDerWaalsContact CG2-OH 3.31Å; I36-Y51 WeakPolarHBondContact CG2-OH 3.37Å; N40-Y51 WeakPolarHBondContact OD1-CE1 3.46Å; N40-Y51 PolarHBondContact OD1-OH 2.84Å; N40-Y51 VanDerWaalsContact OD1-OH 3.06Å; I43-Y51 HydrophobicContact CD1-CD1 3.88Å; I43-Y51 HydrophobicContact CD1-CE1 3.63Å; I43-Y51 HydrophobicContact CG1-CD1 3.83Å; I43-Y51 HydrophobicContact CG1-CE1 3.83Å; I43-Y51 WeakPolarHBondContact O-CA 3.45Å; V44-Y51 HydrophobicContact CG2-CD1 3.83Å; V44-Y51 HydrophobicContact CG2-CE1 3.81Å; Y51-I53 PolarHBondContact O-N 3.15Å; Y51-V110 HydrophobicContact CD1-CG2 3.94Å; Y51-V110 HydrophobicContact CD2-CG1 3.87Å; Y51-V110 HydrophobicContact CD2-CG2 4.27Å; Y51-V110 HydrophobicContact CE1-CG2 3.97Å; Y51-V110 HydrophobicContact CE2-CG1 3.74Å; Y51-V110 HydrophobicContact CE2-CG2 4.29Å; Y51-V110 HydrophobicContact CG-CG1 4.48Å; Y51-V110 HydrophobicContact CG-CG2 4.11Å; Y51-L113 HydrophobicContact CD2-CD1 4.35Å; Y51-L113 HydrophobicContact CD2-CD2 4.4Å; Y51-L113 HydrophobicContact CG-CD2 4.21Å
52	F	98.1	Very high	96.4	Very high	9 Å²	9	51.2 Å²	51.2	4%	0.039	28%	0.278	C	S	.	.			trans	-59.8	127.4	178.8	-64.2	-54	0	0	0	112.5	H42 I43 C45 A55 T64 M102 Q103 V106	H42-F52 WeakPolarHBondContact O-CE2 3.46Å; I43-F52 VanDerWaalsContact O-CD2 3.29Å; I43-F52 WeakPolarHBondContact O-CD2 3.19Å; I43-F52 PolarHBondContact O-N 3.45Å; I43-F52 VanDerWaalsContact O-N 3.15Å; C45-F52 VanDerWaalsContact CA-CE1 3.42Å; C45-F52 HydrophobicContact CB-CD1 3.73Å; C45-F52 HydrophobicContact CB-CE1 3.68Å; F52-A55 HydrophobicContact CB-CB 4Å; F52-A55 HydrophobicContact CG-CB 4.4Å; F52-T64 HydrophobicContact CD1-CG2 4.38Å; F52-T64 HydrophobicContact CD2-CG2 4.44Å; F52-T64 HydrophobicContact CE1-CG2 4.18Å; F52-T64 WeakPolarHBondContact CE1-O 3.39Å; F52-T64 HydrophobicContact CE2-CG2 4.24Å; F52-T64 HydrophobicContact CZ-CG2 4.12Å; F52-T64 WeakPolarHBondContact CZ-O 3.31Å; F52-M102 HydrophobicContact CD2-CE 3.88Å; F52-M102 HydrophobicContact CD2-CG 4.36Å; F52-M102 HydrophobicContact CE2-CE 3.77Å; F52-Q103 PolarHBondContact O-NE2 3.3Å; F52-Q103 PolarHBondContact O-OE1 2.98Å; F52-V106 HydrophobicContact CB-CG1 4.45Å; F52-V106 HydrophobicContact CB-CG2 4.09Å; F52-V106 HydrophobicContact CD2-CG2 3.86Å; F52-V106 HydrophobicContact CG-CG2 4.48Å
53	I	97.1	Very high	96.6	Very high	30 Å²	30	48.5 Å²	48.5	15%	0.154	27%	0.266	C	S	.	.	S	Bend	trans	-122.1	125.2	168.1	-58.1	-60.8	0	0	0	107.1	Y51 C66 K67 Y107 L113 E117	Y51-I53 PolarHBondContact O-N 3.15Å; I53-C66 PolarHBondContact N-SG 2.99Å; I53-C66 VanDerWaalsContact N-SG 3.37Å; I53-C66 VanDerWaalsContact O-CA 3.27Å; I53-C66 WeakPolarHBondContact O-CA 3.48Å; I53-C66 VanDerWaalsContact O-CB 3.3Å; I53-C66 WeakPolarHBondContact O-CB 3.27Å; I53-K67 PolarHBondContact O-N 2.92Å; I53-Y107 HydrophobicContact CD1-CE1 4.12Å; I53-L113 HydrophobicContact CD1-CD1 4.19Å; I53-L113 HydrophobicContact CD1-CG 4.29Å; I53-E117 HydrophobicContact CD1-CB 4.24Å; I53-E117 HydrophobicContact CD1-CG 4.1Å; I53-E117 HydrophobicContact CG2-CG 3.92Å; I53-E117 WeakPolarHBondContact CG2-OE1 3.22Å
54	D	95.6	Very high	96.7	Very high	81 Å²	81	49.4 Å²	49.4	43%	0.433	27%	0.271	S	S	.	.	S	Bend	trans	46.9	61.7	-165.7	-68.8	-21.9	0	0	0	111.5	T56 K67 L98	D54-T56 PolarHBondContact O-N 3.3Å; D54-T56 VanDerWaalsContact O-N 3.13Å; D54-T56 PolarHBondContact O-OG1 2.92Å; D54-K67 HydrophobicContact CB-CB 3.58Å; D54-K67 HydrophobicContact CB-CD 4.2Å; D54-K67 WeakPolarHBondContact O-CB 3.31Å; D54-K67 PolarHBondContact O-N 3.01Å; D54-L98 HydrophobicContact CB-CD2 4.46Å
55	A	97.3	Very high	96.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-46.4	121.8	178.6	0	0	0	0	0	109.8	F52 T64 D99 M102 Q103	F52-A55 HydrophobicContact CB-CB 4Å; F52-A55 HydrophobicContact CG-CB 4.4Å; A55-T64 HydrophobicContact CB-CG2 3.89Å; A55-D99 HydrophobicContact CB-CB 4.37Å; A55-D99 PolarHBondContact O-N 2.89Å; A55-M102 HydrophobicContact CB-CB 4.19Å; A55-M102 HydrophobicContact CB-CG 4.29Å; A55-Q103 HydrophobicContact CB-CB 4.04Å
56	T	96.8	Very high	96.8	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.025	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	118.6	-174.4	-60.2	0	0	0	0	108.3	D54 T64 F65 K67 I70 L96 K97	D54-T56 PolarHBondContact O-N 3.3Å; D54-T56 VanDerWaalsContact O-N 3.13Å; D54-T56 PolarHBondContact O-OG1 2.92Å; T56-T64 WeakPolarHBondContact O-CA 3.4Å; T56-F65 PolarHBondContact N-O 2.91Å; T56-F65 PolarHBondContact O-N 2.81Å; T56-K67 VanDerWaalsContact OG1-CA 3.29Å; T56-K67 WeakPolarHBondContact OG1-CA 3.39Å; T56-K67 VanDerWaalsContact OG1-CB 3.31Å; T56-K67 WeakPolarHBondContact OG1-CB 3.4Å; T56-I70 HydrophobicContact CG2-CG2 3.98Å; T56-L96 HydrophobicContact CG2-CB 3.86Å; T56-L96 HydrophobicContact CG2-CD1 4.3Å; T56-L96 HydrophobicContact CG2-CD2 4.39Å; T56-L96 HydrophobicContact CG2-CG 4.42Å; T56-K97 CarbonylContact C-O 3.57Å; T56-K97 WeakPolarHBondContact CA-O 3.24Å
57	T	96.9	Very high	96.8	Very high	14 Å²	14	44.7 Å²	44.7	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136.3	-175.5	-61.9	0	0	0	0	109.8	L62 H63 T64 K97 D99	T57-L62 HydrophobicContact CG2-CB 4.49Å; T57-L62 HydrophobicContact CG2-CD2 4.35Å; T57-H63 WeakPolarHBondContact CA-O 3.38Å; T57-T64 WeakPolarHBondContact OG1-CG2 3.24Å; T57-T64 PolarHBondContact OG1-OG1 3.29Å; T57-K97 PolarHBondContact N-O 3.42Å; T57-K97 PolarHBondContact O-N 2.95Å; T57-D99 WeakPolarHBondContact OG1-CB 3.49Å; T57-D99 PolarHBondContact OG1-OD2 3.21Å
58	I	96.7	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123.3	171.5	-58.6	169.2	0	0	0	108.2	E60 C61 L62 H63 F65 I70 C80 I87 L96	I58-E60 VanDerWaalsContact C-N 3.32Å; I58-E60 HydrophobicContact CG2-CB 4.34Å; I58-E60 PolarHBondContact O-N 2.86Å; I58-C61 PolarHBondContact O-N 3.34Å; I58-L62 VanDerWaalsContact O-CA 3.26Å; I58-L62 WeakPolarHBondContact O-CA 3.32Å; I58-L62 PolarHBondContact O-N 3.4Å; I58-H63 PolarHBondContact N-O 3.37Å; I58-F65 HydrophobicContact CD1-CD2 4.23Å; I58-F65 HydrophobicContact CD1-CE2 3.59Å; I58-F65 HydrophobicContact CG1-CD2 4.49Å; I58-F65 HydrophobicContact CG1-CE2 4.27Å; I58-I70 HydrophobicContact CD1-CD1 4.3Å; I58-C80 HydrophobicContact CD1-CB 3.94Å; I58-I87 HydrophobicContact CD1-CD1 3.57Å; I58-I87 HydrophobicContact CD1-CG1 4.19Å; I58-I87 HydrophobicContact CG1-CD1 4.06Å; I58-I87 HydrophobicContact CG2-CB 4.42Å; I58-I87 HydrophobicContact CG2-CD1 4.19Å; I58-I87 HydrophobicContact CG2-CG1 3.94Å; I58-I87 HydrophobicContact CG2-CG2 3.92Å; I58-L96 HydrophobicContact CB-CD2 4.47Å; I58-L96 HydrophobicContact CG1-CD2 3.73Å
59	T	94.1	Very high	96.8	Very high	53 Å²	53	44 Å²	44	33%	0.325	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-37.5	-176.4	53.5	0	0	0	0	113.2	C61 N95 K97	T59-C61 PolarHBondContact O-N 3.43Å; T59-N95 PolarHBondContact N-O 3.38Å; T59-N95 WeakPolarHBondContact OG1-CB 3.41Å; T59-N95 PolarHBondContact OG1-O 2.99Å; T59-K97 HydrophobicContact CG2-CB 4.44Å; T59-K97 HydrophobicContact CG2-CG 3.59Å
60	E	94.4	Very high	96.9	Very high	110 Å²	110	40.1 Å²	40.1	51%	0.514	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-28.4	-174.5	-59.3	-50.1	114.7	0	0	114.2	I58 I87	I58-E60 VanDerWaalsContact C-N 3.32Å; I58-E60 HydrophobicContact CG2-CB 4.34Å; I58-E60 PolarHBondContact O-N 2.86Å; E60-I87 WeakPolarHBondContact CG-O 3.45Å
61	C	95.6	Very high	96.9	Very high	22 Å²	22	41 Å²	41	15%	0.149	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.6	0.8	-174	66.2	0	0	0	0	114.7	I58 T59 H63 I85	I58-C61 PolarHBondContact O-N 3.34Å; T59-C61 PolarHBondContact O-N 3.43Å; C61-H63 PolarHBondContact O-N 3.48Å; C61-H63 VanDerWaalsContact O-N 3.08Å; C61-H63 PolarHBondContact O-ND1 2.97Å; C61-H63 PolarHBondContact SG-ND1 3.49Å; C61-I85 HydrophobicContact CB-CB 4.48Å; C61-I85 HydrophobicContact CB-CD1 3.96Å
62	L	96.2	Very high	96.8	Very high	132 Å²	132	45.2 Å²	45.2	69%	0.691	24%	0.239	S	C	*	.			trans	55.9	23.4	177.5	-54.9	-178.2	0	0	0	115.4	T57 I58	T57-L62 HydrophobicContact CG2-CB 4.49Å; T57-L62 HydrophobicContact CG2-CD2 4.35Å; I58-L62 VanDerWaalsContact O-CA 3.26Å; I58-L62 WeakPolarHBondContact O-CA 3.32Å; I58-L62 PolarHBondContact O-N 3.4Å
63	H	97.3	Very high	96.7	Very high	58 Å²	58	48.4 Å²	48.4	27%	0.269	25%	0.251	S	S	.	.			trans	-85.4	134.2	172.5	-72.5	119.2	0	0	0	111.2	T57 I58 C61 F65 M82 C83	T57-H63 WeakPolarHBondContact CA-O 3.38Å; I58-H63 PolarHBondContact N-O 3.37Å; C61-H63 PolarHBondContact O-N 3.48Å; C61-H63 VanDerWaalsContact O-N 3.08Å; C61-H63 PolarHBondContact O-ND1 2.97Å; C61-H63 PolarHBondContact SG-ND1 3.49Å; H63-F65 HydrophobicContact CB-CE2 3.8Å; H63-F65 HydrophobicContact CB-CZ 4.15Å; H63-M82 HydrophobicContact CB-CE 3.43Å; H63-M82 VanDerWaalsContact CB-CE 3.43Å; H63-M82 WeakPolarHBondContact CD2-CE 3.5Å; H63-M82 VanDerWaalsContact CG-CE 3.47Å; H63-C83 PolarHBondContact CE1-SG 3.19Å; H63-C83 PolarHBondContact ND1-SG 3.27Å; H63-C83 VanDerWaalsContact ND1-SG 3.36Å
64	T	97.9	Very high	96.6	Very high	22 Å²	22	47.6 Å²	47.6	14%	0.135	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141.8	-174.4	-48.7	0	0	0	0	112.3	F52 A55 T56 T57 M102	F52-T64 HydrophobicContact CD1-CG2 4.38Å; F52-T64 HydrophobicContact CD2-CG2 4.44Å; F52-T64 HydrophobicContact CE1-CG2 4.18Å; F52-T64 WeakPolarHBondContact CE1-O 3.39Å; F52-T64 HydrophobicContact CE2-CG2 4.24Å; F52-T64 HydrophobicContact CZ-CG2 4.12Å; F52-T64 WeakPolarHBondContact CZ-O 3.31Å; A55-T64 HydrophobicContact CB-CG2 3.89Å; T56-T64 WeakPolarHBondContact O-CA 3.4Å; T57-T64 WeakPolarHBondContact OG1-CG2 3.24Å; T57-T64 PolarHBondContact OG1-OG1 3.29Å; T64-M102 HydrophobicContact CG2-CG 4.25Å
65	F	98.4	Very high	96.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	167	-179.9	-56.4	-88.3	0	0	0	110.6	L47 T56 I58 H63 I70 P81 M82	L47-F65 HydrophobicContact CD1-CD1 3.83Å; L47-F65 HydrophobicContact CD1-CE1 4.39Å; L47-F65 HydrophobicContact CD1-CG 4.38Å; L47-F65 HydrophobicContact CG-CD1 3.9Å; L47-F65 HydrophobicContact CG-CE1 4.23Å; T56-F65 PolarHBondContact N-O 2.91Å; T56-F65 PolarHBondContact O-N 2.81Å; I58-F65 HydrophobicContact CD1-CD2 4.23Å; I58-F65 HydrophobicContact CD1-CE2 3.59Å; I58-F65 HydrophobicContact CG1-CD2 4.49Å; I58-F65 HydrophobicContact CG1-CE2 4.27Å; H63-F65 HydrophobicContact CB-CE2 3.8Å; H63-F65 HydrophobicContact CB-CZ 4.15Å; F65-I70 HydrophobicContact CB-CB 3.76Å; F65-I70 HydrophobicContact CB-CG2 4.18Å; F65-I70 HydrophobicContact CD2-CB 4.27Å; F65-I70 HydrophobicContact CD2-CD1 3.96Å; F65-I70 HydrophobicContact CD2-CG1 4.09Å; F65-I70 HydrophobicContact CE2-CD1 4.21Å; F65-I70 HydrophobicContact CG-CB 4.14Å; F65-I70 HydrophobicContact CG-CD1 4.29Å; F65-I70 HydrophobicContact CG-CG1 4.42Å; F65-P81 HydrophobicContact CE1-CB 4.11Å; F65-P81 HydrophobicContact CE1-CG 3.94Å; F65-P81 HydrophobicContact CZ-CB 4.25Å; F65-P81 HydrophobicContact CZ-CG 3.95Å; F65-M82 HydrophobicContact CE1-CE 4.1Å; F65-M82 HydrophobicContact CE1-CG 3.93Å; F65-M82 HydrophobicContact CE1-SD 4.43Å; F65-M82 HydrophobicContact CE2-CE 4.35Å; F65-M82 HydrophobicContact CZ-CB 4.41Å; F65-M82 HydrophobicContact CZ-CE 3.73Å; F65-M82 HydrophobicContact CZ-CG 3.83Å; F65-M82 HydrophobicContact CZ-SD 4.45Å
66	C	98.4	Very high	96.3	Very high	5 Å²	5	57 Å²	57	3%	0.034	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.1	164.1	-54.7	0	0	0	0	109.9	C45 I53 S68 C69 I70	C45-C66 VanDerWaalsContact CB-SG 3.54Å; C45-C66 PolarHBondContact SG-N 3.32Å; C45-C66 VanDerWaalsContact SG-N 3.38Å; I53-C66 PolarHBondContact N-SG 2.99Å; I53-C66 VanDerWaalsContact N-SG 3.37Å; I53-C66 VanDerWaalsContact O-CA 3.27Å; I53-C66 WeakPolarHBondContact O-CA 3.48Å; I53-C66 VanDerWaalsContact O-CB 3.3Å; I53-C66 WeakPolarHBondContact O-CB 3.27Å; C66-S68 VanDerWaalsContact C-N 3.35Å; C66-S68 PolarHBondContact O-N 3.44Å; C66-C69 HydrophobicContact CB-CB 4.1Å; C66-C69 WeakPolarHBondContact O-CB 3.36Å; C66-C69 PolarHBondContact O-N 3.21Å; C66-I70 PolarHBondContact O-N 3.44Å
67	K	97.1	Very high	96.2	Very high	94 Å²	94	58 Å²	58	41%	0.409	30%	0.304	S	S	.	.	H	α-helix	trans	-50.5	-52.3	-179.6	-175.3	-175.7	-175.9	178.9	0	112.6	I53 D54 T56 C69 I70 V71 L98	I53-K67 PolarHBondContact O-N 2.92Å; D54-K67 HydrophobicContact CB-CB 3.58Å; D54-K67 HydrophobicContact CB-CD 4.2Å; D54-K67 WeakPolarHBondContact O-CB 3.31Å; D54-K67 PolarHBondContact O-N 3.01Å; T56-K67 VanDerWaalsContact OG1-CA 3.29Å; T56-K67 WeakPolarHBondContact OG1-CA 3.39Å; T56-K67 VanDerWaalsContact OG1-CB 3.31Å; T56-K67 WeakPolarHBondContact OG1-CB 3.4Å; K67-C69 VanDerWaalsContact C-N 3.28Å; K67-C69 PolarHBondContact O-N 2.9Å; K67-I70 PolarHBondContact O-N 3.36Å; K67-V71 HydrophobicContact CG-CG2 4.31Å; K67-V71 VanDerWaalsContact O-CB 3.28Å; K67-V71 WeakPolarHBondContact O-CB 3.48Å; K67-V71 WeakPolarHBondContact O-CG2 3.31Å; K67-V71 PolarHBondContact O-N 3.49Å; K67-L98 HydrophobicContact CD-CD2 4.12Å
68	S	96.6	Very high	96	Very high	87 Å²	87	61.3 Å²	61.3	61%	0.608	32%	0.318	S	S	*	.	H	α-helix	trans	-62.1	-35.7	-178.6	57.5	0	0	0	0	112.4	C66 K72	C66-S68 VanDerWaalsContact C-N 3.35Å; C66-S68 PolarHBondContact O-N 3.44Å; S68-K72 WeakPolarHBondContact O-CB 3.48Å; S68-K72 PolarHBondContact O-N 3.36Å; S68-K72 VanDerWaalsContact O-N 3.16Å
69	C	98.1	Very high	96	Very high	26 Å²	26	66 Å²	66	18%	0.176	34%	0.336	C	S	.	.	H	α-helix	trans	-68.7	-53.2	179.2	-64.1	0	0	0	0	111.8	L47 C66 K67 K72 Y73	L47-C69 HydrophobicContact CB-CB 3.86Å; L47-C69 HydrophobicContact CD1-CB 3.74Å; L47-C69 HydrophobicContact CG-CB 4.47Å; C66-C69 HydrophobicContact CB-CB 4.1Å; C66-C69 WeakPolarHBondContact O-CB 3.36Å; C66-C69 PolarHBondContact O-N 3.21Å; K67-C69 VanDerWaalsContact C-N 3.28Å; K67-C69 PolarHBondContact O-N 2.9Å; C69-K72 PolarHBondContact O-N 3.48Å; C69-Y73 WeakPolarHBondContact O-CB 3.48Å; C69-Y73 PolarHBondContact O-N 2.94Å
70	I	97.6	Very high	96.1	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-39.2	-176.4	-171	58.7	0	0	0	111.7	L47 T56 I58 F65 C66 K67 K72 Y73 L74 P81 L96	L47-I70 HydrophobicContact CD1-CD1 4.48Å; T56-I70 HydrophobicContact CG2-CG2 3.98Å; I58-I70 HydrophobicContact CD1-CD1 4.3Å; F65-I70 HydrophobicContact CB-CB 3.76Å; F65-I70 HydrophobicContact CB-CG2 4.18Å; F65-I70 HydrophobicContact CD2-CB 4.27Å; F65-I70 HydrophobicContact CD2-CD1 3.96Å; F65-I70 HydrophobicContact CD2-CG1 4.09Å; F65-I70 HydrophobicContact CE2-CD1 4.21Å; F65-I70 HydrophobicContact CG-CB 4.14Å; F65-I70 HydrophobicContact CG-CD1 4.29Å; F65-I70 HydrophobicContact CG-CG1 4.42Å; C66-I70 PolarHBondContact O-N 3.44Å; K67-I70 PolarHBondContact O-N 3.36Å; I70-K72 VanDerWaalsContact C-N 3.33Å; I70-K72 PolarHBondContact O-N 3.06Å; I70-Y73 HydrophobicContact CD1-CD1 4.46Å; I70-Y73 PolarHBondContact O-N 3.2Å; I70-L74 HydrophobicContact CD1-CD1 4Å; I70-L74 HydrophobicContact CD1-CD2 4.43Å; I70-L74 HydrophobicContact CD1-CG 4.01Å; I70-L74 HydrophobicContact CG1-CD1 3.78Å; I70-L74 HydrophobicContact CG1-CG 4.24Å; I70-L74 WeakPolarHBondContact O-CB 3.49Å; I70-L74 VanDerWaalsContact O-CG 3.25Å; I70-L74 WeakPolarHBondContact O-CG 3.48Å; I70-L74 PolarHBondContact O-N 3.02Å; I70-P81 HydrophobicContact CD1-CG 4.01Å; I70-L96 HydrophobicContact CG1-CD1 4.42Å; I70-L96 HydrophobicContact CG1-CD2 4.09Å; I70-L96 HydrophobicContact CG2-CD1 4.14Å
71	V	96.1	Very high	96.2	Very high	49 Å²	49	59.4 Å²	59.4	30%	0.297	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-43.4	176.4	171.6	0	0	0	0	110.7	K67 L74 L93 L96	K67-V71 HydrophobicContact CG-CG2 4.31Å; K67-V71 VanDerWaalsContact O-CB 3.28Å; K67-V71 WeakPolarHBondContact O-CB 3.48Å; K67-V71 WeakPolarHBondContact O-CG2 3.31Å; K67-V71 PolarHBondContact O-N 3.49Å; V71-L74 PolarHBondContact O-N 2.9Å; V71-L93 HydrophobicContact CB-CD2 4.45Å; V71-L93 HydrophobicContact CG1-CD2 4.23Å; V71-L93 HydrophobicContact CG2-CD2 4.15Å; V71-L96 HydrophobicContact CG2-CD1 4.23Å
72	K	96.8	Very high	96.2	Very high	152 Å²	152	62.2 Å²	62.2	66%	0.661	32%	0.315	S	S	*	.	H	α-helix	trans	-63.4	-45.5	176.2	-176.2	179.2	179.2	-178.5	0	111.8	S68 C69 I70 L74 Q75	S68-K72 WeakPolarHBondContact O-CB 3.48Å; S68-K72 PolarHBondContact O-N 3.36Å; S68-K72 VanDerWaalsContact O-N 3.16Å; C69-K72 PolarHBondContact O-N 3.48Å; I70-K72 VanDerWaalsContact C-N 3.33Å; I70-K72 PolarHBondContact O-N 3.06Å; K72-L74 VanDerWaalsContact C-N 3.29Å; K72-L74 PolarHBondContact O-N 3.16Å; K72-Q75 WeakPolarHBondContact O-CB 3.45Å; K72-Q75 PolarHBondContact O-N 3.14Å
73	Y	96.6	Very high	96.2	Very high	76 Å²	76	58.1 Å²	58.1	30%	0.298	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-38.7	179.5	178.9	-90.9	0	0	0	112.4	L47 C69 I70 Q75 T76 S77 Y79 P81	L47-Y73 HydrophobicContact CD2-CD2 4.09Å; L47-Y73 HydrophobicContact CD2-CG 4.44Å; C69-Y73 WeakPolarHBondContact O-CB 3.48Å; C69-Y73 PolarHBondContact O-N 2.94Å; I70-Y73 HydrophobicContact CD1-CD1 4.46Å; I70-Y73 PolarHBondContact O-N 3.2Å; Y73-Q75 PolarHBondContact O-N 3.15Å; Y73-T76 PolarHBondContact O-N 3.08Å; Y73-T76 VanDerWaalsContact O-N 3.17Å; Y73-T76 PolarHBondContact O-OG1 2.9Å; Y73-T76 VanDerWaalsContact O-OG1 3.06Å; Y73-S77 PolarHBondContact O-N 3.49Å; Y73-Y79 VanDerWaalsContact CE1-O 3.3Å; Y73-Y79 WeakPolarHBondContact CE1-O 3.45Å; Y73-P81 HydrophobicContact CD1-CG 3.67Å; Y73-P81 HydrophobicContact CD2-CG 4.39Å; Y73-P81 HydrophobicContact CE1-CB 4.37Å; Y73-P81 HydrophobicContact CE1-CG 3.63Å; Y73-P81 HydrophobicContact CE2-CG 4.35Å; Y73-P81 HydrophobicContact CG-CG 4.06Å
74	L	95.3	Very high	96.1	Very high	14 Å²	14	60.7 Å²	60.7	7%	0.073	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-2.3	-178.3	-64.7	173	0	0	0	114.6	I70 V71 K72 S77 I87 P92 L93 L96	I70-L74 HydrophobicContact CD1-CD1 4Å; I70-L74 HydrophobicContact CD1-CD2 4.43Å; I70-L74 HydrophobicContact CD1-CG 4.01Å; I70-L74 HydrophobicContact CG1-CD1 3.78Å; I70-L74 HydrophobicContact CG1-CG 4.24Å; I70-L74 WeakPolarHBondContact O-CB 3.49Å; I70-L74 VanDerWaalsContact O-CG 3.25Å; I70-L74 WeakPolarHBondContact O-CG 3.48Å; I70-L74 PolarHBondContact O-N 3.02Å; V71-L74 PolarHBondContact O-N 2.9Å; K72-L74 VanDerWaalsContact C-N 3.29Å; K72-L74 PolarHBondContact O-N 3.16Å; L74-S77 CarbonylContact C-O 3.18Å; L74-S77 WeakPolarHBondContact CA-O 3.46Å; L74-S77 VanDerWaalsContact CD2-O 3.27Å; L74-S77 WeakPolarHBondContact CD2-O 3.29Å; L74-I87 HydrophobicContact CD1-CD1 3.85Å; L74-I87 HydrophobicContact CD2-CD1 3.49Å; L74-I87 VanDerWaalsContact CD2-CD1 3.49Å; L74-I87 HydrophobicContact CG-CD1 4.27Å; L74-P92 HydrophobicContact CB-CB 4.43Å; L74-P92 HydrophobicContact CB-CG 4.08Å; L74-P92 HydrophobicContact CD1-CB 4.1Å; L74-P92 HydrophobicContact CD2-CB 4.13Å; L74-P92 HydrophobicContact CD2-CG 4.48Å; L74-P92 HydrophobicContact CG-CB 4.44Å; L74-L93 HydrophobicContact CB-CD2 4.48Å; L74-L93 HydrophobicContact CD1-CD2 4.46Å; L74-L96 HydrophobicContact CD1-CD1 3.9Å; L74-L96 HydrophobicContact CD1-CD2 4.12Å; L74-L96 HydrophobicContact CD1-CG 4.3Å
75	Q	93.2	Very high	96	Very high	152 Å²	152	63.6 Å²	63.6	71%	0.71	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-28.2	167	-65.1	176.2	-22.6	0	0	111.5	K72 Y73	K72-Q75 WeakPolarHBondContact O-CB 3.45Å; K72-Q75 PolarHBondContact O-N 3.14Å; Y73-Q75 PolarHBondContact O-N 3.15Å
76	T	92.5	Very high	95.9	Very high	127 Å²	127	67.2 Å²	67.2	78%	0.779	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-14.9	-176.2	52.1	0	0	0	0	113.9	Y73	Y73-T76 PolarHBondContact O-N 3.08Å; Y73-T76 VanDerWaalsContact O-N 3.17Å; Y73-T76 PolarHBondContact O-OG1 2.9Å; Y73-T76 VanDerWaalsContact O-OG1 3.06Å
77	S	93.6	Very high	95.6	Very high	25 Å²	25	67 Å²	67	18%	0.175	34%	0.341	C	S	.	.			trans	-138.7	155.6	-177.6	-177.9	0	0	0	0	111.5	Y73 L74 Y79	Y73-S77 PolarHBondContact O-N 3.49Å; L74-S77 CarbonylContact C-O 3.18Å; L74-S77 WeakPolarHBondContact CA-O 3.46Å; L74-S77 VanDerWaalsContact CD2-O 3.27Å; L74-S77 WeakPolarHBondContact CD2-O 3.29Å; S77-Y79 PolarHBondContact OG-N 3.38Å
78	K	94	Very high	95.4	Very high	84 Å²	84	65 Å²	65	37%	0.365	33%	0.333	S	S	.	.	S	Bend	trans	-112.6	8.8	174.3	-62.7	179.4	177.6	177.4	0	112.8	I87 E89 P92	K78-I87 PolarHBondContact O-N 3.23Å; K78-E89 WeakPolarHBondContact CD-O 3.3Å; K78-E89 PolarHBondContact NZ-O 3.13Å; K78-P92 HydrophobicContact CG-CG 4.24Å
79	Y	96.3	Very high	94.9	Very high	99 Å²	99	66.5 Å²	66.5	39%	0.388	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-112.7	151.4	-173.8	-62.9	-92.9	0	0	0	110.7	Y73 S77 N84 I85 K86	Y73-Y79 VanDerWaalsContact CE1-O 3.3Å; Y73-Y79 WeakPolarHBondContact CE1-O 3.45Å; S77-Y79 PolarHBondContact OG-N 3.38Å; Y79-N84 WeakPolarHBondContact CB-OD1 3.01Å; Y79-N84 WeakPolarHBondContact CD1-O 3.23Å; Y79-I85 CarbonylContact C-O 3.46Å; Y79-I85 WeakPolarHBondContact CA-O 3.46Å; Y79-K86 HydrophobicContact CD1-CB 3.87Å; Y79-K86 HydrophobicContact CD1-CG 4.35Å; Y79-K86 HydrophobicContact CE1-CB 3.69Å; Y79-K86 HydrophobicContact CE1-CD 4.4Å; Y79-K86 HydrophobicContact CE1-CG 4.01Å
80	C	97.2	Very high	94.3	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.007	35%	0.35	C	S	.	.			trans	-65.6	131.8	175.2	177.4	0	0	0	0	110.8	I58 M82 C83 N84 I85	I58-C80 HydrophobicContact CD1-CB 3.94Å; C80-M82 PolarHBondContact O-N 3.34Å; C80-M82 PolarHBondContact SG-N 3.11Å; C80-M82 VanDerWaalsContact SG-N 3.45Å; C80-C83 VanDerWaalsContact CB-SG 3.57Å; C80-N84 VanDerWaalsContact O-CA 3.23Å; C80-N84 WeakPolarHBondContact O-CA 3.41Å; C80-N84 PolarHBondContact O-N 2.89Å; C80-I85 PolarHBondContact N-O 3.4Å
81	P	96.2	Very high	93.8	Very high	23 Å²	23	75.2 Å²	75.2	15%	0.149	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25	176.8	-20	27.5	0	0	0	115.1	Y46 L47 F65 I70 Y73	Y46-P81 HydrophobicContact CD1-CB 4.33Å; L47-P81 HydrophobicContact CD1-CG 4.17Å; L47-P81 HydrophobicContact CD2-CB 3.9Å; L47-P81 HydrophobicContact CD2-CG 3.94Å; L47-P81 HydrophobicContact CG-CB 4.49Å; L47-P81 HydrophobicContact CG-CG 4.29Å; F65-P81 HydrophobicContact CE1-CB 4.11Å; F65-P81 HydrophobicContact CE1-CG 3.94Å; F65-P81 HydrophobicContact CZ-CB 4.25Å; F65-P81 HydrophobicContact CZ-CG 3.95Å; I70-P81 HydrophobicContact CD1-CG 4.01Å; Y73-P81 HydrophobicContact CD1-CG 3.67Å; Y73-P81 HydrophobicContact CD2-CG 4.39Å; Y73-P81 HydrophobicContact CE1-CB 4.37Å; Y73-P81 HydrophobicContact CE1-CG 3.63Å; Y73-P81 HydrophobicContact CE2-CG 4.35Å; Y73-P81 HydrophobicContact CG-CG 4.06Å
82	M	95	Very high	93.2	Very high	80 Å²	80	73.4 Å²	73.4	39%	0.394	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-42.8	-174.5	-72.1	-158	-70.5	0	0	113.6	Y46 H63 F65 C80	Y46-M82 HydrophobicContact CD1-CG 3.95Å; Y46-M82 HydrophobicContact CD2-CG 4.26Å; Y46-M82 HydrophobicContact CD2-SD 4.28Å; Y46-M82 HydrophobicContact CG-CG 3.79Å; Y46-M82 HydrophobicContact CG-SD 4.05Å; H63-M82 HydrophobicContact CB-CE 3.43Å; H63-M82 VanDerWaalsContact CB-CE 3.43Å; H63-M82 WeakPolarHBondContact CD2-CE 3.5Å; H63-M82 VanDerWaalsContact CG-CE 3.47Å; F65-M82 HydrophobicContact CE1-CE 4.1Å; F65-M82 HydrophobicContact CE1-CG 3.93Å; F65-M82 HydrophobicContact CE1-SD 4.43Å; F65-M82 HydrophobicContact CE2-CE 4.35Å; F65-M82 HydrophobicContact CZ-CB 4.41Å; F65-M82 HydrophobicContact CZ-CE 3.73Å; F65-M82 HydrophobicContact CZ-CG 3.83Å; F65-M82 HydrophobicContact CZ-SD 4.45Å; C80-M82 PolarHBondContact O-N 3.34Å; C80-M82 PolarHBondContact SG-N 3.11Å; C80-M82 VanDerWaalsContact SG-N 3.45Å
83	C	96.7	Very high	92.9	Very high	46 Å²	46	70.8 Å²	70.8	31%	0.311	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-1	-174.8	63.7	0	0	0	0	114.4	H63 C80 I85	H63-C83 PolarHBondContact CE1-SG 3.19Å; H63-C83 PolarHBondContact ND1-SG 3.27Å; H63-C83 VanDerWaalsContact ND1-SG 3.36Å; C80-C83 VanDerWaalsContact CB-SG 3.57Å; C83-I85 HydrophobicContact CB-CD1 4.41Å; C83-I85 HydrophobicContact CB-CG1 4.34Å; C83-I85 PolarHBondContact O-N 3.3Å
84	N	95.4	Very high	92.5	Very high	113 Å²	113	71.8 Å²	71.8	60%	0.604	37%	0.367	S	S	*	.			trans	56.5	20.1	-178.7	-157.2	39.1	0	0	0	115	Y79 C80	Y79-N84 WeakPolarHBondContact CB-OD1 3.01Å; Y79-N84 WeakPolarHBondContact CD1-O 3.23Å; C80-N84 VanDerWaalsContact O-CA 3.23Å; C80-N84 WeakPolarHBondContact O-CA 3.41Å; C80-N84 PolarHBondContact O-N 2.89Å
85	I	95.6	Very high	92.2	Very high	83 Å²	83	72.9 Å²	72.9	43%	0.426	37%	0.373	S	S	.	.			trans	-72.6	135.8	170.8	-66.4	174.2	0	0	0	108.7	C61 Y79 C80 C83 I87	C61-I85 HydrophobicContact CB-CB 4.48Å; C61-I85 HydrophobicContact CB-CD1 3.96Å; Y79-I85 CarbonylContact C-O 3.46Å; Y79-I85 WeakPolarHBondContact CA-O 3.46Å; C80-I85 PolarHBondContact N-O 3.4Å; C83-I85 HydrophobicContact CB-CD1 4.41Å; C83-I85 HydrophobicContact CB-CG1 4.34Å; C83-I85 PolarHBondContact O-N 3.3Å; I85-I87 PolarHBondContact O-N 2.75Å
86	K	95	Very high	92.3	Very high	75 Å²	75	66.7 Å²	66.7	33%	0.326	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-67.6	122.9	176.2	-167.6	179.1	-176.2	-173.7	0	109.7	Y79 E89	Y79-K86 HydrophobicContact CD1-CB 3.87Å; Y79-K86 HydrophobicContact CD1-CG 4.35Å; Y79-K86 HydrophobicContact CE1-CB 3.69Å; Y79-K86 HydrophobicContact CE1-CD 4.4Å; Y79-K86 HydrophobicContact CE1-CG 4.01Å; K86-E89 IonicContact NZ-OE1 3.99Å; K86-E89 PolarHBondContact NZ-OE1 2.87Å; K86-E89 IonicContact NZ-OE2 4Å; K86-E89 PolarHBondContact NZ-OE2 3.5Å
87	I	93.4	Very high	92.3	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.01	34%	0.335	C	S	.	.			trans	-76.4	-41.9	-175.3	-59.8	-179.4	0	0	0	111	I58 E60 L74 K78 I85 P92 N95	I58-I87 HydrophobicContact CD1-CD1 3.57Å; I58-I87 HydrophobicContact CD1-CG1 4.19Å; I58-I87 HydrophobicContact CG1-CD1 4.06Å; I58-I87 HydrophobicContact CG2-CB 4.42Å; I58-I87 HydrophobicContact CG2-CD1 4.19Å; I58-I87 HydrophobicContact CG2-CG1 3.94Å; I58-I87 HydrophobicContact CG2-CG2 3.92Å; E60-I87 WeakPolarHBondContact CG-O 3.45Å; L74-I87 HydrophobicContact CD1-CD1 3.85Å; L74-I87 HydrophobicContact CD2-CD1 3.49Å; L74-I87 VanDerWaalsContact CD2-CD1 3.49Å; L74-I87 HydrophobicContact CG-CD1 4.27Å; K78-I87 PolarHBondContact O-N 3.23Å; I85-I87 PolarHBondContact O-N 2.75Å; I87-P92 HydrophobicContact CB-CB 4.14Å; I87-P92 HydrophobicContact CG2-CB 4.12Å; I87-P92 WeakPolarHBondContact CG2-O 3.27Å; I87-N95 HydrophobicContact CG2-CB 3.77Å; I87-N95 PolarHBondContact O-ND2 3.39Å
88	H	92.8	Very high	92.3	Very high	50 Å²	50	70 Å²	70	23%	0.231	35%	0.349	C	S	.	.			trans	-161.6	157	179.1	-168.6	-78.5	0	0	0	110.2	T90 Q91	H88-T90 PolarHBondContact CE1-OG1 2.83Å; H88-T90 PolarHBondContact ND1-N 3.18Å; H88-Q91 WeakPolarHBondContact CB-O 3.11Å; H88-Q91 VanDerWaalsContact CG-O 3.31Å; H88-Q91 PolarHBondContact ND1-N 3.46Å
89	E	85.9	Confident	92.3	Very high	120 Å²	120	68.2 Å²	68.2	56%	0.561	34%	0.344	S	S	*	.	S	Bend	trans	-60.9	-56.4	177.9	-71.2	-58.6	134.7	0	0	113.7	K78 K86	K78-E89 WeakPolarHBondContact CD-O 3.3Å; K78-E89 PolarHBondContact NZ-O 3.13Å; K86-E89 IonicContact NZ-OE1 3.99Å; K86-E89 PolarHBondContact NZ-OE1 2.87Å; K86-E89 IonicContact NZ-OE2 4Å; K86-E89 PolarHBondContact NZ-OE2 3.5Å
90	T	84.6	Confident	91.9	Very high	95 Å²	95	70.2 Å²	70.2	58%	0.583	35%	0.35	S	S	*	.	S	Bend	trans	-115.2	-43.3	-175.7	50.5	0	0	0	0	113.8	H88 P92	H88-T90 PolarHBondContact CE1-OG1 2.83Å; H88-T90 PolarHBondContact ND1-N 3.18Å; T90-P92 WeakPolarHBondContact O-CD 3.48Å
91	Q	87.9	Confident	91.5	Very high	114 Å²	114	74.2 Å²	74.2	53%	0.533	37%	0.374	S	S	.	.			trans	-121.9	84.6	-171.2	-64.5	-179	-7.6	0	0	112.3	H88 L93 L94	H88-Q91 WeakPolarHBondContact CB-O 3.11Å; H88-Q91 VanDerWaalsContact CG-O 3.31Å; H88-Q91 PolarHBondContact ND1-N 3.46Å; Q91-L93 PolarHBondContact O-N 3.42Å; Q91-L93 VanDerWaalsContact O-N 3.13Å; Q91-L94 HydrophobicContact CB-CD1 3.97Å; Q91-L94 HydrophobicContact CB-CG 4.01Å; Q91-L94 PolarHBondContact O-N 3.13Å; Q91-L94 VanDerWaalsContact OE1-CD1 3.25Å
92	P	83.6	Confident	91.4	Very high	11 Å²	11	74.6 Å²	74.6	7%	0.071	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-63.9	-19.6	-176.8	28.3	-37.1	0	0	0	114	L74 K78 I87 T90 L94	L74-P92 HydrophobicContact CB-CB 4.43Å; L74-P92 HydrophobicContact CB-CG 4.08Å; L74-P92 HydrophobicContact CD1-CB 4.1Å; L74-P92 HydrophobicContact CD2-CB 4.13Å; L74-P92 HydrophobicContact CD2-CG 4.48Å; L74-P92 HydrophobicContact CG-CB 4.44Å; K78-P92 HydrophobicContact CG-CG 4.24Å; I87-P92 HydrophobicContact CB-CB 4.14Å; I87-P92 HydrophobicContact CG2-CB 4.12Å; I87-P92 WeakPolarHBondContact CG2-O 3.27Å; T90-P92 WeakPolarHBondContact O-CD 3.48Å; P92-L94 VanDerWaalsContact C-N 3.31Å; P92-L94 PolarHBondContact O-N 3.33Å
93	L	89.9	Confident	91.5	Very high	96 Å²	96	71.4 Å²	71.4	50%	0.503	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-68.9	-23.5	177.6	-60.6	179.4	0	0	0	113.9	V71 L74 Q91 N95 L96	V71-L93 HydrophobicContact CB-CD2 4.45Å; V71-L93 HydrophobicContact CG1-CD2 4.23Å; V71-L93 HydrophobicContact CG2-CD2 4.15Å; L74-L93 HydrophobicContact CB-CD2 4.48Å; L74-L93 HydrophobicContact CD1-CD2 4.46Å; Q91-L93 PolarHBondContact O-N 3.42Å; Q91-L93 VanDerWaalsContact O-N 3.13Å; L93-N95 VanDerWaalsContact C-N 3.28Å; L93-N95 PolarHBondContact O-N 3.06Å; L93-L96 HydrophobicContact CD2-CD1 3.87Å; L93-L96 PolarHBondContact O-N 3.46Å
94	L	88.1	Confident	91.2	Very high	97 Å²	97	71.5 Å²	71.5	51%	0.508	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-67.6	-30.2	-179.8	-69.1	-178.6	0	0	0	112.9	Q91 P92 L96	Q91-L94 HydrophobicContact CB-CD1 3.97Å; Q91-L94 HydrophobicContact CB-CG 4.01Å; Q91-L94 PolarHBondContact O-N 3.13Å; Q91-L94 VanDerWaalsContact OE1-CD1 3.25Å; P92-L94 VanDerWaalsContact C-N 3.31Å; P92-L94 PolarHBondContact O-N 3.33Å; L94-L96 VanDerWaalsContact C-N 3.3Å; L94-L96 PolarHBondContact O-N 3.38Å
95	N	90.4	Very high	91	Very high	37 Å²	37	69.6 Å²	69.6	20%	0.198	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-95.2	19.9	-178.3	-74	-4.1	0	0	0	112.7	T59 I87 L93	T59-N95 PolarHBondContact N-O 3.38Å; T59-N95 WeakPolarHBondContact OG1-CB 3.41Å; T59-N95 PolarHBondContact OG1-O 2.99Å; I87-N95 HydrophobicContact CG2-CB 3.77Å; I87-N95 PolarHBondContact O-ND2 3.39Å; L93-N95 VanDerWaalsContact C-N 3.28Å; L93-N95 PolarHBondContact O-N 3.06Å
96	L	94.3	Very high	91	Very high	22 Å²	22	65.7 Å²	65.7	12%	0.115	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.8	169.2	-61.1	-175.7	0	0	0	110.1	T56 I58 I70 V71 L74 L93 L94	T56-L96 HydrophobicContact CG2-CB 3.86Å; T56-L96 HydrophobicContact CG2-CD1 4.3Å; T56-L96 HydrophobicContact CG2-CD2 4.39Å; T56-L96 HydrophobicContact CG2-CG 4.42Å; I58-L96 HydrophobicContact CB-CD2 4.47Å; I58-L96 HydrophobicContact CG1-CD2 3.73Å; I70-L96 HydrophobicContact CG1-CD1 4.42Å; I70-L96 HydrophobicContact CG1-CD2 4.09Å; I70-L96 HydrophobicContact CG2-CD1 4.14Å; V71-L96 HydrophobicContact CG2-CD1 4.23Å; L74-L96 HydrophobicContact CD1-CD1 3.9Å; L74-L96 HydrophobicContact CD1-CD2 4.12Å; L74-L96 HydrophobicContact CD1-CG 4.3Å; L93-L96 HydrophobicContact CD2-CD1 3.87Å; L93-L96 PolarHBondContact O-N 3.46Å; L94-L96 VanDerWaalsContact C-N 3.3Å; L94-L96 PolarHBondContact O-N 3.38Å
97	K	92.9	Very high	90.9	Very high	131 Å²	131	64.2 Å²	64.2	57%	0.57	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.8	173.1	-63.2	-65.8	177.1	-172.8	0	110.1	T56 T57 T59 D99	T56-K97 CarbonylContact C-O 3.57Å; T56-K97 WeakPolarHBondContact CA-O 3.24Å; T57-K97 PolarHBondContact N-O 3.42Å; T57-K97 PolarHBondContact O-N 2.95Å; T59-K97 HydrophobicContact CG2-CB 4.44Å; T59-K97 HydrophobicContact CG2-CG 3.59Å; K97-D99 PolarHBondContact O-N 3.38Å
98	L	92.4	Very high	90.8	Very high	91 Å²	91	70.7 Å²	70.7	48%	0.476	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	123.4	170.5	-69.5	174	0	0	0	109	D54 K67 R100	D54-L98 HydrophobicContact CB-CD2 4.46Å; K67-L98 HydrophobicContact CD-CD2 4.12Å; L98-R100 PolarHBondContact O-N 3.01Å
99	D	94.2	Very high	90.7	Very high	47 Å²	47	71.6 Å²	71.6	25%	0.251	35%	0.352	S	S	.	.			trans	-95.6	81.3	177.8	-164.1	-28.1	0	0	0	109.5	A55 T57 K97 V101 M102 Q103	A55-D99 HydrophobicContact CB-CB 4.37Å; A55-D99 PolarHBondContact O-N 2.89Å; T57-D99 WeakPolarHBondContact OG1-CB 3.49Å; T57-D99 PolarHBondContact OG1-OD2 3.21Å; K97-D99 PolarHBondContact O-N 3.38Å; D99-V101 PolarHBondContact O-N 2.75Å; D99-V101 PolarHBondContact OD1-N 3.41Å; D99-M102 HydrophobicContact CB-CB 3.9Å; D99-M102 PolarHBondContact O-N 3.46Å; D99-M102 VanDerWaalsContact OD1-CB 3.28Å; D99-M102 WeakPolarHBondContact OD1-CB 2.85Å; D99-M102 PolarHBondContact OD1-N 3.48Å; D99-Q103 PolarHBondContact O-N 2.95Å
100	R	89.4	Confident	91.1	Very high	140 Å²	140	66.4 Å²	66.4	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-61.5	-35	-177.8	-61.3	-174	-176.9	-168.5	1.9	111.9	L98 Q103 D104	L98-R100 PolarHBondContact O-N 3.01Å; R100-Q103 PolarHBondContact O-N 3.4Å; R100-D104 WeakPolarHBondContact O-CB 3.45Å; R100-D104 VanDerWaalsContact O-CG 3.27Å; R100-D104 PolarHBondContact O-N 2.81Å
101	V	89	Confident	91.5	Very high	85 Å²	85	67 Å²	67	52%	0.515	33%	0.334	S	S	.	.	H	α-helix	trans	-68.5	-46.2	179.9	178.6	0	0	0	0	109.8	D99 Q103 D104 I105	D99-V101 PolarHBondContact O-N 2.75Å; D99-V101 PolarHBondContact OD1-N 3.41Å; V101-Q103 VanDerWaalsContact C-N 3.31Å; V101-Q103 PolarHBondContact O-N 2.9Å; V101-D104 PolarHBondContact O-N 3.41Å; V101-I105 HydrophobicContact CG1-CD1 4.03Å; V101-I105 VanDerWaalsContact O-CG1 3.28Å; V101-I105 WeakPolarHBondContact O-CG1 3.13Å; V101-I105 PolarHBondContact O-N 2.82Å
102	M	94.1	Very high	91.7	Very high	31 Å²	31	63.4 Å²	63.4	15%	0.153	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-40.7	176	-170.5	58	-167.8	0	0	111.7	H42 I43 F52 A55 T64 D99 D104 I105 V106	H42-M102 WeakPolarHBondContact O-CE 3.18Å; I43-M102 HydrophobicContact CB-CE 4.45Å; I43-M102 HydrophobicContact CG2-CE 3.84Å; F52-M102 HydrophobicContact CD2-CE 3.88Å; F52-M102 HydrophobicContact CD2-CG 4.36Å; F52-M102 HydrophobicContact CE2-CE 3.77Å; A55-M102 HydrophobicContact CB-CB 4.19Å; A55-M102 HydrophobicContact CB-CG 4.29Å; T64-M102 HydrophobicContact CG2-CG 4.25Å; D99-M102 HydrophobicContact CB-CB 3.9Å; D99-M102 PolarHBondContact O-N 3.46Å; D99-M102 VanDerWaalsContact OD1-CB 3.28Å; D99-M102 WeakPolarHBondContact OD1-CB 2.85Å; D99-M102 PolarHBondContact OD1-N 3.48Å; M102-D104 PolarHBondContact O-N 2.87Å; M102-I105 WeakPolarHBondContact O-CB 3.12Å; M102-I105 PolarHBondContact O-N 3.34Å; M102-I105 HydrophobicContact SD-CD1 4.49Å; M102-V106 HydrophobicContact CE-CG2 3.95Å; M102-V106 WeakPolarHBondContact O-CG2 3.24Å; M102-V106 PolarHBondContact O-N 3.38Å
103	Q	95.1	Very high	92.2	Very high	13 Å²	13	63.9 Å²	63.9	6%	0.061	33%	0.33	C	S	.	.	H	α-helix	trans	-61.2	-44.2	175	-170.2	59.4	53.7	0	0	112.2	F52 A55 D99 R100 V101 I105 V106 Y107	F52-Q103 PolarHBondContact O-NE2 3.3Å; F52-Q103 PolarHBondContact O-OE1 2.98Å; A55-Q103 HydrophobicContact CB-CB 4.04Å; D99-Q103 PolarHBondContact O-N 2.95Å; R100-Q103 PolarHBondContact O-N 3.4Å; V101-Q103 VanDerWaalsContact C-N 3.31Å; V101-Q103 PolarHBondContact O-N 2.9Å; Q103-I105 VanDerWaalsContact C-N 3.31Å; Q103-I105 PolarHBondContact O-N 3.17Å; Q103-V106 PolarHBondContact O-N 2.86Å; Q103-Y107 HydrophobicContact CG-CD2 3.96Å; Q103-Y107 HydrophobicContact CG-CE2 3.65Å; Q103-Y107 PolarHBondContact NE2-OH 3.28Å; Q103-Y107 PolarHBondContact O-N 2.95Å
104	D	90.4	Very high	92.5	Very high	49 Å²	49	63.8 Å²	63.8	26%	0.262	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-40.1	176.6	-77.3	-9.4	0	0	0	111.8	R100 V101 M102 K108	R100-D104 WeakPolarHBondContact O-CB 3.45Å; R100-D104 VanDerWaalsContact O-CG 3.27Å; R100-D104 PolarHBondContact O-N 2.81Å; V101-D104 PolarHBondContact O-N 3.41Å; M102-D104 PolarHBondContact O-N 2.87Å; D104-K108 WeakPolarHBondContact O-CB 3.47Å; D104-K108 WeakPolarHBondContact O-CD 3.45Å; D104-K108 VanDerWaalsContact O-CG 3.22Å; D104-K108 WeakPolarHBondContact O-CG 3.44Å; D104-K108 PolarHBondContact O-N 2.98Å
105	I	92.4	Very high	92.7	Very high	73 Å²	73	66.4 Å²	66.4	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-59.9	-50.3	175.2	-72.1	165.8	0	0	0	109.5	V101 M102 Q103 Y107 K108 L109	V101-I105 HydrophobicContact CG1-CD1 4.03Å; V101-I105 VanDerWaalsContact O-CG1 3.28Å; V101-I105 WeakPolarHBondContact O-CG1 3.13Å; V101-I105 PolarHBondContact O-N 2.82Å; M102-I105 WeakPolarHBondContact O-CB 3.12Å; M102-I105 PolarHBondContact O-N 3.34Å; M102-I105 HydrophobicContact SD-CD1 4.49Å; Q103-I105 VanDerWaalsContact C-N 3.31Å; Q103-I105 PolarHBondContact O-N 3.17Å; I105-Y107 PolarHBondContact O-N 2.85Å; I105-K108 PolarHBondContact O-N 3.48Å; I105-L109 HydrophobicContact CG2-CD1 3.49Å; I105-L109 VanDerWaalsContact CG2-CD1 3.49Å; I105-L109 HydrophobicContact CG2-CG 4.19Å; I105-L109 WeakPolarHBondContact O-CB 3.29Å; I105-L109 WeakPolarHBondContact O-CG 3.49Å; I105-L109 PolarHBondContact O-N 2.94Å
106	V	94.9	Very high	92.9	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-46.4	-178.8	176	0	0	0	0	111.1	I43 F52 M102 Q103 K108 L109 V110 L113	I43-V106 HydrophobicContact CB-CG2 4.03Å; I43-V106 HydrophobicContact CG2-CG2 4.11Å; F52-V106 HydrophobicContact CB-CG1 4.45Å; F52-V106 HydrophobicContact CB-CG2 4.09Å; F52-V106 HydrophobicContact CD2-CG2 3.86Å; F52-V106 HydrophobicContact CG-CG2 4.48Å; M102-V106 HydrophobicContact CE-CG2 3.95Å; M102-V106 WeakPolarHBondContact O-CG2 3.24Å; M102-V106 PolarHBondContact O-N 3.38Å; Q103-V106 PolarHBondContact O-N 2.86Å; V106-K108 VanDerWaalsContact C-N 3.35Å; V106-K108 PolarHBondContact O-N 3.32Å; V106-L109 PolarHBondContact O-N 3.46Å; V106-V110 HydrophobicContact CG1-CG2 4.5Å; V106-V110 PolarHBondContact O-N 3.05Å; V106-L113 HydrophobicContact CG1-CD2 3.63Å
107	Y	94.4	Very high	93	Very high	45 Å²	45	67.2 Å²	67.2	18%	0.176	34%	0.343	C	S	.	.	H	α-helix	trans	-66.5	-32.1	178.3	-73.5	-25.2	0	0	0	113.9	I53 Q103 I105 L113 Q114	I53-Y107 HydrophobicContact CD1-CE1 4.12Å; Q103-Y107 HydrophobicContact CG-CD2 3.96Å; Q103-Y107 HydrophobicContact CG-CE2 3.65Å; Q103-Y107 PolarHBondContact NE2-OH 3.28Å; Q103-Y107 PolarHBondContact O-N 2.95Å; I105-Y107 PolarHBondContact O-N 2.85Å; Y107-L113 HydrophobicContact CD1-CB 4.46Å; Y107-L113 HydrophobicContact CD1-CD2 4.05Å; Y107-L113 HydrophobicContact CD1-CG 4.14Å; Y107-L113 HydrophobicContact CE1-CD2 4.28Å; Y107-L113 HydrophobicContact CE1-CG 4.17Å; Y107-Q114 HydrophobicContact CD1-CB 3.74Å; Y107-Q114 HydrophobicContact CD1-CG 4.36Å; Y107-Q114 HydrophobicContact CD2-CB 4.15Å; Y107-Q114 HydrophobicContact CD2-CG 3.95Å; Y107-Q114 HydrophobicContact CE1-CB 4.07Å; Y107-Q114 HydrophobicContact CE1-CG 4.44Å; Y107-Q114 HydrophobicContact CE2-CB 4.45Å; Y107-Q114 HydrophobicContact CE2-CG 4.04Å; Y107-Q114 HydrophobicContact CG-CB 3.78Å; Y107-Q114 HydrophobicContact CG-CG 4.12Å
108	K	90.5	Very high	92.8	Very high	137 Å²	137	64.1 Å²	64.1	60%	0.596	33%	0.333	S	S	*	.	H	α-helix	trans	-76.2	-31.9	174.7	-73.4	168	-179.3	165.2	0	112.7	D104 I105 V106 H159	D104-K108 WeakPolarHBondContact O-CB 3.47Å; D104-K108 WeakPolarHBondContact O-CD 3.45Å; D104-K108 VanDerWaalsContact O-CG 3.22Å; D104-K108 WeakPolarHBondContact O-CG 3.44Å; D104-K108 PolarHBondContact O-N 2.98Å; I105-K108 PolarHBondContact O-N 3.48Å; V106-K108 VanDerWaalsContact C-N 3.35Å; V106-K108 PolarHBondContact O-N 3.32Å; K108-H159 PolarHBondContact NZ-CE1 3.43Å; K108-H159 PolarHBondContact NZ-NE2 3.43Å
109	L	91.5	Very high	92.8	Very high	70 Å²	70	65.9 Å²	65.9	37%	0.366	34%	0.336	S	S	.	.	H	α-helix	trans	-82.1	-36.1	-177.8	-72.4	175.8	0	0	0	113.2	L39 I43 I105 V106 P111	L39-L109 HydrophobicContact CD1-CD1 4.11Å; L39-L109 HydrophobicContact CD1-CD2 4.06Å; I43-L109 HydrophobicContact CG2-CD1 4.23Å; I105-L109 HydrophobicContact CG2-CD1 3.49Å; I105-L109 VanDerWaalsContact CG2-CD1 3.49Å; I105-L109 HydrophobicContact CG2-CG 4.19Å; I105-L109 WeakPolarHBondContact O-CB 3.29Å; I105-L109 WeakPolarHBondContact O-CG 3.49Å; I105-L109 PolarHBondContact O-N 2.94Å; V106-L109 PolarHBondContact O-N 3.46Å; L109-P111 WeakPolarHBondContact O-CD 3.27Å
110	V	93.7	Very high	92.8	Very high	11 Å²	11	70.8 Å²	70.8	7%	0.067	35%	0.351	C	S	.	.	S	Bend	trans	-101.9	108.3	-174.6	-172.9	0	0	0	0	110.4	I43 Y51 V106 G112 L113	I43-V110 HydrophobicContact CD1-CG2 3.83Å; Y51-V110 HydrophobicContact CD1-CG2 3.94Å; Y51-V110 HydrophobicContact CD2-CG1 3.87Å; Y51-V110 HydrophobicContact CD2-CG2 4.27Å; Y51-V110 HydrophobicContact CE1-CG2 3.97Å; Y51-V110 HydrophobicContact CE2-CG1 3.74Å; Y51-V110 HydrophobicContact CE2-CG2 4.29Å; Y51-V110 HydrophobicContact CG-CG1 4.48Å; Y51-V110 HydrophobicContact CG-CG2 4.11Å; V106-V110 HydrophobicContact CG1-CG2 4.5Å; V106-V110 PolarHBondContact O-N 3.05Å; V110-G112 PolarHBondContact O-N 2.88Å; V110-L113 HydrophobicContact CB-CB 3.95Å; V110-L113 HydrophobicContact CB-CD2 3.93Å; V110-L113 HydrophobicContact CG1-CB 3.83Å; V110-L113 HydrophobicContact CG1-CD2 4.17Å; V110-L113 HydrophobicContact CG1-CG 4.47Å; V110-L113 HydrophobicContact CG2-CD2 4.32Å; V110-L113 WeakPolarHBondContact O-CB 3.47Å; V110-L113 PolarHBondContact O-N 3.09Å
111	P	91.9	Very high	92.8	Very high	107 Å²	107	66.1 Å²	66.1	70%	0.695	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	136.1	-177.9	-22.6	34.2	0	0	0	112.5	L109 L113	L109-P111 WeakPolarHBondContact O-CD 3.27Å; P111-L113 PolarHBondContact O-N 3.26Å; P111-L113 VanDerWaalsContact O-N 3.12Å
112	G	92.8	Very high	92.8	Very high	38 Å²	38	68 Å²	68	39%	0.392	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	-3.1	175.5	0	0	0	0	0	115.6	V110 S116	V110-G112 PolarHBondContact O-N 2.88Å; G112-S116 VanDerWaalsContact O-CB 3.29Å; G112-S116 WeakPolarHBondContact O-CB 3.22Å; G112-S116 PolarHBondContact O-N 2.93Å; G112-S116 PolarHBondContact O-OG 3.1Å
113	L	95.1	Very high	92.7	Very high	22 Å²	22	71.1 Å²	71.1	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-51.3	-178.2	-177.9	64.8	0	0	0	111.7	Y51 I53 V106 Y107 V110 P111 E115 S116 E117	Y51-L113 HydrophobicContact CD2-CD1 4.35Å; Y51-L113 HydrophobicContact CD2-CD2 4.4Å; Y51-L113 HydrophobicContact CG-CD2 4.21Å; I53-L113 HydrophobicContact CD1-CD1 4.19Å; I53-L113 HydrophobicContact CD1-CG 4.29Å; V106-L113 HydrophobicContact CG1-CD2 3.63Å; Y107-L113 HydrophobicContact CD1-CB 4.46Å; Y107-L113 HydrophobicContact CD1-CD2 4.05Å; Y107-L113 HydrophobicContact CD1-CG 4.14Å; Y107-L113 HydrophobicContact CE1-CD2 4.28Å; Y107-L113 HydrophobicContact CE1-CG 4.17Å; V110-L113 HydrophobicContact CB-CB 3.95Å; V110-L113 HydrophobicContact CB-CD2 3.93Å; V110-L113 HydrophobicContact CG1-CB 3.83Å; V110-L113 HydrophobicContact CG1-CD2 4.17Å; V110-L113 HydrophobicContact CG1-CG 4.47Å; V110-L113 HydrophobicContact CG2-CD2 4.32Å; V110-L113 WeakPolarHBondContact O-CB 3.47Å; V110-L113 PolarHBondContact O-N 3.09Å; P111-L113 PolarHBondContact O-N 3.26Å; P111-L113 VanDerWaalsContact O-N 3.12Å; L113-E115 PolarHBondContact O-N 3.41Å; L113-S116 PolarHBondContact O-N 3.47Å; L113-S116 PolarHBondContact O-OG 3.3Å; L113-E117 PolarHBondContact O-N 2.91Å
114	Q	94.2	Very high	92.6	Very high	94 Å²	94	75.3 Å²	75.3	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-47	179.8	-173.7	177.5	-9.1	0	0	111.7	Y107 S116 E117 D118	Y107-Q114 HydrophobicContact CD1-CB 3.74Å; Y107-Q114 HydrophobicContact CD1-CG 4.36Å; Y107-Q114 HydrophobicContact CD2-CB 4.15Å; Y107-Q114 HydrophobicContact CD2-CG 3.95Å; Y107-Q114 HydrophobicContact CE1-CB 4.07Å; Y107-Q114 HydrophobicContact CE1-CG 4.44Å; Y107-Q114 HydrophobicContact CE2-CB 4.45Å; Y107-Q114 HydrophobicContact CE2-CG 4.04Å; Y107-Q114 HydrophobicContact CG-CB 3.78Å; Y107-Q114 HydrophobicContact CG-CG 4.12Å; Q114-S116 VanDerWaalsContact C-N 3.31Å; Q114-S116 PolarHBondContact O-N 2.96Å; Q114-E117 PolarHBondContact O-N 3.45Å; Q114-D118 PolarHBondContact O-N 3.12Å
115	E	93.6	Very high	92.5	Very high	151 Å²	151	77 Å²	77	71%	0.706	37%	0.373	S	S	*	.	H	α-helix	trans	-60.6	-41.6	178.3	-63.6	173	178.8	0	0	111.7	L113 E117 K119	L113-E115 PolarHBondContact O-N 3.41Å; E115-E117 VanDerWaalsContact C-N 3.33Å; E115-E117 PolarHBondContact O-N 2.95Å; E115-K119 VanDerWaalsContact O-CB 3.31Å; E115-K119 WeakPolarHBondContact O-CB 3.35Å; E115-K119 PolarHBondContact O-N 3.38Å
116	S	95.1	Very high	92.4	Very high	43 Å²	43	79.2 Å²	79.2	30%	0.301	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-37.9	177.6	77.6	0	0	0	0	112.4	G112 L113 Q114 R120	G112-S116 VanDerWaalsContact O-CB 3.29Å; G112-S116 WeakPolarHBondContact O-CB 3.22Å; G112-S116 PolarHBondContact O-N 2.93Å; G112-S116 PolarHBondContact O-OG 3.1Å; L113-S116 PolarHBondContact O-N 3.47Å; L113-S116 PolarHBondContact O-OG 3.3Å; Q114-S116 VanDerWaalsContact C-N 3.31Å; Q114-S116 PolarHBondContact O-N 2.96Å; S116-R120 WeakPolarHBondContact O-CG 3.34Å; S116-R120 PolarHBondContact O-N 3.25Å
117	E	94.6	Very high	92.3	Very high	34 Å²	34	83.7 Å²	83.7	16%	0.159	41%	0.413	C	S	.	.	H	α-helix	trans	-72	-45.5	177.7	-174.4	60	-165.4	0	0	111.2	I53 L113 Q114 E115 K119 R120 I121	I53-E117 HydrophobicContact CD1-CB 4.24Å; I53-E117 HydrophobicContact CD1-CG 4.1Å; I53-E117 HydrophobicContact CG2-CG 3.92Å; I53-E117 WeakPolarHBondContact CG2-OE1 3.22Å; L113-E117 PolarHBondContact O-N 2.91Å; Q114-E117 PolarHBondContact O-N 3.45Å; E115-E117 VanDerWaalsContact C-N 3.33Å; E115-E117 PolarHBondContact O-N 2.95Å; E117-K119 PolarHBondContact O-N 2.98Å; E117-R120 PolarHBondContact O-N 3.12Å; E117-R120 VanDerWaalsContact O-N 3.12Å; E117-R120 IonicContact OE2-NH1 2.75Å; E117-I121 HydrophobicContact CG-CD1 4.03Å; E117-I121 VanDerWaalsContact O-CG1 3.32Å; E117-I121 WeakPolarHBondContact O-CG1 3.43Å; E117-I121 PolarHBondContact O-N 2.93Å
118	D	90.1	Very high	92.1	Very high	66 Å²	66	89.5 Å²	89.5	35%	0.353	44%	0.435	S	S	.	.	H	α-helix	trans	-58.7	-38.2	175	-83.9	-39.2	0	0	0	112	Q114 K122 R132	Q114-D118 PolarHBondContact O-N 3.12Å; D118-K122 WeakPolarHBondContact O-CB 3.45Å; D118-K122 PolarHBondContact O-N 3.45Å; D118-R132 IonicContact OD1-NH1 2.6Å; D118-R132 PolarHBondContact OD1-NH1 3.24Å
119	K	93.1	Very high	92	Very high	128 Å²	128	86.4 Å²	86.4	56%	0.557	44%	0.442	S	S	*	.	H	α-helix	trans	-62.8	-49.1	173.3	-179.4	176.8	171.7	-179.5	0	111.7	E115 E117 I121 K122 E123	E115-K119 VanDerWaalsContact O-CB 3.31Å; E115-K119 WeakPolarHBondContact O-CB 3.35Å; E115-K119 PolarHBondContact O-N 3.38Å; E117-K119 PolarHBondContact O-N 2.98Å; K119-I121 VanDerWaalsContact C-N 3.33Å; K119-I121 PolarHBondContact O-N 2.78Å; K119-K122 WeakPolarHBondContact O-CB 3.33Å; K119-K122 PolarHBondContact O-N 3.07Å; K119-E123 WeakPolarHBondContact CE-OE1 3.44Å; K119-E123 HydrophobicContact CG-CG 4.48Å; K119-E123 IonicContact NZ-OE1 3.19Å; K119-E123 WeakPolarHBondContact O-CG 3.15Å; K119-E123 PolarHBondContact O-N 2.94Å
120	R	93.3	Very high	91.7	Very high	150 Å²	150	87.9 Å²	87.9	57%	0.566	45%	0.449	S	S	*	.	H	α-helix	trans	-59.6	-43.4	177.8	-74.4	171.7	-177.7	170.6	1.2	112.1	S116 E117 E123 F124	S116-R120 WeakPolarHBondContact O-CG 3.34Å; S116-R120 PolarHBondContact O-N 3.25Å; E117-R120 PolarHBondContact O-N 3.12Å; E117-R120 VanDerWaalsContact O-N 3.12Å; E117-R120 IonicContact OE2-NH1 2.75Å; R120-E123 PolarHBondContact O-N 3.18Å; R120-F124 WeakPolarHBondContact O-CB 3.22Å; R120-F124 PolarHBondContact O-N 3.14Å
121	I	89.2	Confident	90.7	Very high	42 Å²	42	95.9 Å²	95.9	22%	0.215	49%	0.486	C	S	.	.	H	α-helix	trans	-59.4	-49.8	176	-69.3	169.1	0	0	0	109.4	E117 K119 E123 F124 Y125	E117-I121 HydrophobicContact CG-CD1 4.03Å; E117-I121 VanDerWaalsContact O-CG1 3.32Å; E117-I121 WeakPolarHBondContact O-CG1 3.43Å; E117-I121 PolarHBondContact O-N 2.93Å; K119-I121 VanDerWaalsContact C-N 3.33Å; K119-I121 PolarHBondContact O-N 2.78Å; I121-E123 PolarHBondContact O-N 2.54Å; I121-F124 PolarHBondContact O-N 2.96Å; I121-Y125 HydrophobicContact CG2-CD2 3.85Å; I121-Y125 HydrophobicContact CG2-CE2 3.78Å; I121-Y125 VanDerWaalsContact O-CD2 3.25Å; I121-Y125 WeakPolarHBondContact O-CD2 2.91Å; I121-Y125 PolarHBondContact O-N 2.97Å; I121-Y125 VanDerWaalsContact O-N 3.16Å
122	K	89.1	Confident	89.6	Confident	123 Å²	123	96.1 Å²	96.1	54%	0.535	47%	0.473	S	S	.	.	H	α-helix	trans	-58.6	-47.8	179.9	-175.6	177.6	178.6	179.5	0	112	D118 K119 F124 Y125 Q126	D118-K122 WeakPolarHBondContact O-CB 3.45Å; D118-K122 PolarHBondContact O-N 3.45Å; K119-K122 WeakPolarHBondContact O-CB 3.33Å; K119-K122 PolarHBondContact O-N 3.07Å; K122-F124 VanDerWaalsContact C-N 3.33Å; K122-F124 PolarHBondContact O-N 2.95Å; K122-Y125 PolarHBondContact O-N 3.34Å; K122-Q126 HydrophobicContact CG-CG 4.38Å; K122-Q126 WeakPolarHBondContact O-CB 3.26Å; K122-Q126 VanDerWaalsContact O-CG 3.23Å; K122-Q126 WeakPolarHBondContact O-CG 3.47Å; K122-Q126 PolarHBondContact O-N 3.32Å
123	E	92.9	Very high	88.1	Confident	97 Å²	97	100 Å²	100	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-60.5	-41.3	178.3	-72.7	171.6	175.1	0	0	111.8	K119 R120 I121 Q126 S127	K119-E123 WeakPolarHBondContact CE-OE1 3.44Å; K119-E123 HydrophobicContact CG-CG 4.48Å; K119-E123 IonicContact NZ-OE1 3.19Å; K119-E123 WeakPolarHBondContact O-CG 3.15Å; K119-E123 PolarHBondContact O-N 2.94Å; R120-E123 PolarHBondContact O-N 3.18Å; I121-E123 PolarHBondContact O-N 2.54Å; E123-Q126 PolarHBondContact O-N 2.85Å; E123-S127 WeakPolarHBondContact O-CB 3.43Å; E123-S127 PolarHBondContact O-N 2.78Å; E123-S127 PolarHBondContact O-OG 3.01Å
124	F	91.6	Very high	86.1	Confident	102 Å²	102	103.7 Å²	103.7	45%	0.447	51%	0.512	S	S	.	.	H	α-helix	trans	-59.9	-49.7	177.4	177.2	-94.1	0	0	0	112.3	R120 I121 K122 S127	R120-F124 WeakPolarHBondContact O-CB 3.22Å; R120-F124 PolarHBondContact O-N 3.14Å; I121-F124 PolarHBondContact O-N 2.96Å; K122-F124 VanDerWaalsContact C-N 3.33Å; K122-F124 PolarHBondContact O-N 2.95Å; F124-S127 PolarHBondContact O-N 2.85Å; F124-S127 PolarHBondContact O-OG 2.94Å
125	Y	88.3	Confident	83.7	Confident	84 Å²	84	106.9 Å²	106.9	33%	0.329	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-42.9	179.6	-79	-78.7	0	0	0	112	I121 K122 S127 R128 G129 L130 R132	I121-Y125 HydrophobicContact CG2-CD2 3.85Å; I121-Y125 HydrophobicContact CG2-CE2 3.78Å; I121-Y125 VanDerWaalsContact O-CD2 3.25Å; I121-Y125 WeakPolarHBondContact O-CD2 2.91Å; I121-Y125 PolarHBondContact O-N 2.97Å; I121-Y125 VanDerWaalsContact O-N 3.16Å; K122-Y125 PolarHBondContact O-N 3.34Å; Y125-S127 VanDerWaalsContact C-N 3.31Å; Y125-S127 PolarHBondContact O-N 2.85Å; Y125-R128 PolarHBondContact O-N 2.94Å; Y125-G129 PolarHBondContact O-N 2.71Å; Y125-L130 CarbonylContact C-O 3.48Å; Y125-L130 HydrophobicContact CD1-CB 3.99Å; Y125-L130 HydrophobicContact CD1-CD1 4.47Å; Y125-L130 PolarHBondContact O-N 2.91Å; Y125-L130 VanDerWaalsContact O-N 3.11Å; Y125-R132 HydrophobicContact CD2-CB 4.45Å; Y125-R132 HydrophobicContact CD2-CG 4.44Å; Y125-R132 HydrophobicContact CE2-CG 4.48Å
126	Q	90.1	Very high	81.1	Confident	120 Å²	120	104.5 Å²	104.5	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-59.2	-42.1	176.8	-74.7	-179.7	-22.3	0	0	112.1	K122 E123 R128 G129	K122-Q126 HydrophobicContact CG-CG 4.38Å; K122-Q126 WeakPolarHBondContact O-CB 3.26Å; K122-Q126 VanDerWaalsContact O-CG 3.23Å; K122-Q126 WeakPolarHBondContact O-CG 3.47Å; K122-Q126 PolarHBondContact O-N 3.32Å; E123-Q126 PolarHBondContact O-N 2.85Å; Q126-R128 PolarHBondContact O-N 3.5Å; Q126-R128 VanDerWaalsContact O-N 3.09Å; Q126-G129 PolarHBondContact O-N 3.2Å
127	S	92.9	Very high	78.5	Confident	93 Å²	93	107.6 Å²	107.6	65%	0.65	55%	0.547	S	S	*	.	H	α-helix	trans	-62	-18.7	178.3	74.8	0	0	0	0	113.9	E123 F124 Y125	E123-S127 WeakPolarHBondContact O-CB 3.43Å; E123-S127 PolarHBondContact O-N 2.78Å; E123-S127 PolarHBondContact O-OG 3.01Å; F124-S127 PolarHBondContact O-N 2.85Å; F124-S127 PolarHBondContact O-OG 2.94Å; Y125-S127 VanDerWaalsContact C-N 3.31Å; Y125-S127 PolarHBondContact O-N 2.85Å
128	R	91.6	Very high	76	Confident	168 Å²	168	108.1 Å²	108.1	63%	0.634	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	6.8	179	-60.8	-163.9	-176.9	-131	0.3	113.6	Y125 Q126 L130	Y125-R128 PolarHBondContact O-N 2.94Å; Q126-R128 PolarHBondContact O-N 3.5Å; Q126-R128 VanDerWaalsContact O-N 3.09Å; R128-L130 HydrophobicContact CB-CD1 4.22Å; R128-L130 HydrophobicContact CB-CG 4.29Å; R128-L130 PolarHBondContact O-N 3Å
129	G	87	Confident	73.5	Confident	72 Å²	72	113.7 Å²	113.7	74%	0.742	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.3	22	-177.2	0	0	0	0	0	113.7	Y125 Q126	Y125-G129 PolarHBondContact O-N 2.71Å; Q126-G129 PolarHBondContact O-N 3.2Å
130	L	85.5	Confident	70.9	Confident	100 Å²	100	115.3 Å²	115.3	52%	0.524	60%	0.6	S	S	.	*			trans	-101.1	135.9	179	-66.3	173.1	0	0	0	109.7	Y125 R128	Y125-L130 CarbonylContact C-O 3.48Å; Y125-L130 HydrophobicContact CD1-CB 3.99Å; Y125-L130 HydrophobicContact CD1-CD1 4.47Å; Y125-L130 PolarHBondContact O-N 2.91Å; Y125-L130 VanDerWaalsContact O-N 3.11Å; R128-L130 HydrophobicContact CB-CD1 4.22Å; R128-L130 HydrophobicContact CB-CG 4.29Å; R128-L130 PolarHBondContact O-N 3Å
131	E	73.8	Confident	68.2	Low	180 Å²	180	113.4 Å²	113.4	84%	0.841	61%	0.61	S	S	*	*			trans	-79	136.1	166.1	-163.2	161	-162.6	0	0	108.8	V133	E131-V133 PolarHBondContact O-N 3.25Å
132	R	68.6	Low	65.7	Low	112 Å²	112	119 Å²	119	42%	0.423	64%	0.638	S	S	.	*			trans	-61.8	109.2	179.2	-178.7	-179.8	177.3	169.1	-1.4	107.7	D118 Y125 V134	D118-R132 IonicContact OD1-NH1 2.6Å; D118-R132 PolarHBondContact OD1-NH1 3.24Å; Y125-R132 HydrophobicContact CD2-CB 4.45Å; Y125-R132 HydrophobicContact CD2-CG 4.44Å; Y125-R132 HydrophobicContact CE2-CG 4.48Å; R132-V134 HydrophobicContact CG-CG2 4Å; R132-V134 PolarHBondContact O-N 3.4Å
133	V	60	Low	63.2	Low	119 Å²	119	118.8 Å²	118.8	72%	0.721	65%	0.65	S	S	*	*			trans	-67.7	89.8	162.5	-177.5	0	0	0	0	106	E131 Q135	E131-V133 PolarHBondContact O-N 3.25Å; V133-Q135 HydrophobicContact CG1-CG 4.35Å; V133-Q135 PolarHBondContact O-N 3.46Å
134	V	54.5	Low	60.4	Low	99 Å²	99	120.4 Å²	120.4	60%	0.6	66%	0.661	S	S	*	*			trans	-66.5	94.7	160.6	-178.8	0	0	0	0	103.6	R132 P136	R132-V134 HydrophobicContact CG-CG2 4Å; R132-V134 PolarHBondContact O-N 3.4Å; V134-P136 WeakPolarHBondContact O-CD 3.44Å
135	Q	43.9	Very low	58.2	Low	162 Å²	162	120.3 Å²	120.3	76%	0.757	68%	0.679	S	S	*	*			trans	-54.5	116.4	159.4	-77.4	-169.6	24.5	0	0	104.2	V133 S137	V133-Q135 HydrophobicContact CG1-CG 4.35Å; V133-Q135 PolarHBondContact O-N 3.46Å; Q135-S137 PolarHBondContact O-N 2.88Å; Q135-S137 VanDerWaalsContact O-N 3.17Å
136	P	37.9	Very low	56.3	Low	101 Å²	101	121.5 Å²	121.5	66%	0.656	70%	0.695	S	S	*	*			trans	-50.7	133.2	165.9	-16.4	29.4	0	0	0	104.9	V134 G138	V134-P136 WeakPolarHBondContact O-CD 3.44Å; P136-G138 PolarHBondContact O-N 3.07Å
137	S	40	Very low	53.8	Low	108 Å²	108	119.4 Å²	119.4	76%	0.755	71%	0.706	S	S	*	*	S	Bend	trans	-69.5	54.5	165.9	56.5	0	0	0	0	109.4	Q135	Q135-S137 PolarHBondContact O-N 2.88Å; Q135-S137 VanDerWaalsContact O-N 3.17Å
138	G	42.8	Very low	51.1	Low	45 Å²	45	122.4 Å²	122.4	46%	0.464	71%	0.714	S	S	.	*			trans	-129.2	101.1	165.9	0	0	0	0	0	103.8	P136 D140	P136-G138 PolarHBondContact O-N 3.07Å; G138-D140 PolarHBondContact O-N 3.48Å
139	E	38.1	Very low	48.3	Very low	182 Å²	182	120 Å²	120	85%	0.85	72%	0.72	S	S	*	*			trans	-55	110.1	159.3	-73.1	172.6	140.6	0	0	105.7	S141	E139-S141 PolarHBondContact O-N 2.86Å
140	D	37.9	Very low	46	Very low	162 Å²	162	125.6 Å²	125.6	87%	0.866	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-53.3	125.9	171.9	-87.1	-39.9	0	0	0	108	G138 I142	G138-D140 PolarHBondContact O-N 3.48Å; D140-I142 PolarHBondContact O-N 3.22Å
141	S	37.5	Very low	44	Very low	111 Å²	111	126.2 Å²	126.2	78%	0.776	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-65.8	116.7	-173	-49.6	0	0	0	0	109.7	E139 P143	E139-S141 PolarHBondContact O-N 2.86Å; S141-P143 WeakPolarHBondContact O-CD 3.27Å
142	I	35.4	Very low	42.7	Very low	158 Å²	158	123.6 Å²	123.6	81%	0.81	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-73.6	119.4	150.6	-57.8	-176.4	0	0	0	105.2	D140 D144	D140-I142 PolarHBondContact O-N 3.22Å; I142-D144 PolarHBondContact O-N 2.77Å
143	P	37.7	Very low	42	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	72%	0.724	S	S	*	*			trans	-71.7	102.4	174.5	21	-16.4	0	0	0	107.9	S141	S141-P143 WeakPolarHBondContact O-CD 3.27Å
144	D	32.9	Very low	42	Very low	131 Å²	131	118 Å²	118	70%	0.701	70%	0.7	S	S	*	*			trans	-71.5	141.9	164	-163.8	5.7	0	0	0	109.1	I142 T146	I142-D144 PolarHBondContact O-N 2.77Å; D144-T146 PolarHBondContact O-N 3.47Å
145	A	46.6	Very low	42.5	Very low	99 Å²	99	120.4 Å²	120.4	82%	0.818	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	30.1	-162	0	0	0	0	0	115
146	T	47.2	Very low	42.9	Very low	110 Å²	110	113.8 Å²	113.8	68%	0.675	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	7.9	-176.7	39.9	0	0	0	0	115.9	D144 L148	D144-T146 PolarHBondContact O-N 3.47Å; T146-L148 PolarHBondContact O-N 3.39Å
147	G	38	Very low	44	Very low	75 Å²	75	113 Å²	113	77%	0.773	66%	0.662	S	S	*	*			trans	60.5	15.4	154.5	0	0	0	0	0	117.6
148	L	35.5	Very low	45.4	Very low	157 Å²	157	110 Å²	110	82%	0.822	64%	0.644	S	S	*	*			trans	-104.8	112.3	171	-72.3	172.7	0	0	0	108.7	T146 F150	T146-L148 PolarHBondContact O-N 3.39Å; L148-F150 VanDerWaalsContact C-N 3.28Å; L148-F150 PolarHBondContact O-N 3.01Å
149	P	33.8	Very low	46.5	Very low	118 Å²	118	112 Å²	112	77%	0.766	64%	0.641	S	S	*	*			trans	-72.7	87.8	175.6	28.3	-30.4	0	0	0	108.8	T151	P149-T151 PolarHBondContact O-N 3.15Å
150	F	38.3	Very low	48.3	Very low	188 Å²	188	107.5 Å²	107.5	83%	0.825	62%	0.619	S	S	*	*			trans	-75.7	85.2	159.5	-144.7	-89	0	0	0	106.2	L148 T152	L148-F150 VanDerWaalsContact C-N 3.28Å; L148-F150 PolarHBondContact O-N 3.01Å; F150-T152 PolarHBondContact O-N 3.3Å
151	T	42.9	Very low	50.4	Low	114 Å²	114	106.3 Å²	106.3	70%	0.699	60%	0.603	S	S	*	*			trans	-55.6	114.7	168.9	59.1	0	0	0	0	106.2	P149 F153	P149-T151 PolarHBondContact O-N 3.15Å; T151-F153 VanDerWaalsContact C-N 3.28Å; T151-F153 PolarHBondContact O-N 2.95Å
152	T	48.1	Very low	52.5	Low	124 Å²	124	108.2 Å²	108.2	76%	0.761	59%	0.593	S	S	*	*			trans	-60.5	96.2	176.3	42.6	0	0	0	0	107.6	F150 D154	F150-T152 PolarHBondContact O-N 3.3Å; T152-D154 PolarHBondContact O-N 2.98Å; T152-D154 VanDerWaalsContact O-N 3.13Å
153	F	53.7	Low	54.6	Low	76 Å²	76	104.6 Å²	104.6	33%	0.333	57%	0.57	S	S	.	*			trans	-66.1	117.5	-178.2	-177.5	-88.6	0	0	0	107.8	T151 H155 A158 Y163	T151-F153 VanDerWaalsContact C-N 3.28Å; T151-F153 PolarHBondContact O-N 2.95Å; F153-H155 PolarHBondContact O-CD2 3.26Å; F153-H155 PolarHBondContact O-N 2.91Å; F153-A158 HydrophobicContact CE1-CB 3.75Å; F153-A158 HydrophobicContact CZ-CB 4.43Å; F153-Y163 HydrophobicContact CD2-CE1 4.39Å; F153-Y163 AromaticContact CE2-CD1 3.81Å; F153-Y163 HydrophobicContact CE2-CD1 3.81Å; F153-Y163 HydrophobicContact CE2-CD2 4.45Å; F153-Y163 AromaticContact CE2-CE1 3.25Å; F153-Y163 HydrophobicContact CE2-CE1 3.25Å; F153-Y163 AromaticContact CE2-CE2 3.97Å; F153-Y163 HydrophobicContact CE2-CE2 3.97Å; F153-Y163 HydrophobicContact CE2-CG 4.31Å; F153-Y163 AromaticContact CE2-CZ 3.23Å; F153-Y163 VanDerWaalsContact CE2-OH 3.29Å; F153-Y163 WeakPolarHBondContact CE2-OH 3.27Å; F153-Y163 AromaticContact CZ-CD1 3.95Å; F153-Y163 HydrophobicContact CZ-CD1 3.95Å; F153-Y163 AromaticContact CZ-CD2 3.86Å; F153-Y163 HydrophobicContact CZ-CD2 3.86Å; F153-Y163 AromaticContact CZ-CE1 3.67Å; F153-Y163 HydrophobicContact CZ-CE1 3.67Å; F153-Y163 AromaticContact CZ-CE2 3.58Å; F153-Y163 HydrophobicContact CZ-CE2 3.58Å; F153-Y163 AromaticContact CZ-CG 3.96Å; F153-Y163 HydrophobicContact CZ-CG 3.96Å; F153-Y163 AromaticContact CZ-CZ 3.36Å
154	D	60.1	Low	56.8	Low	39 Å²	39	100.1 Å²	100.1	21%	0.209	54%	0.54	C	S	.	.			trans	-64.2	96.3	176.2	-179.7	8.7	0	0	0	109.7	T152 S156 K157	T152-D154 PolarHBondContact O-N 2.98Å; T152-D154 VanDerWaalsContact O-N 3.13Å; D154-S156 PolarHBondContact O-N 3.48Å; D154-S156 VanDerWaalsContact O-N 3.09Å; D154-S156 WeakPolarHBondContact OD1-CB 3.34Å; D154-S156 PolarHBondContact OD1-N 3.04Å; D154-S156 PolarHBondContact OD1-OG 3.43Å; D154-S156 PolarHBondContact OD2-OG 3.48Å; D154-K157 HydrophobicContact CB-CD 4.3Å; D154-K157 PolarHBondContact O-N 3.28Å; D154-K157 VanDerWaalsContact OD2-CD 3.31Å; D154-K157 WeakPolarHBondContact OD2-CD 3.27Å; D154-K157 WeakPolarHBondContact OD2-CE 3.4Å; D154-K157 IonicContact OD2-NZ 2.79Å; D154-K157 PolarHBondContact OD2-NZ 3.45Å; D154-K157 VanDerWaalsContact OD2-NZ 3.11Å
155	H	63.7	Low	59.3	Low	149 Å²	149	99.7 Å²	99.7	69%	0.69	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-59.4	-22.2	-176.6	-70.9	-82.6	0	0	0	112.8	F153 K157 A158	F153-H155 PolarHBondContact O-CD2 3.26Å; F153-H155 PolarHBondContact O-N 2.91Å; H155-K157 PolarHBondContact O-N 2.94Å; H155-A158 WeakPolarHBondContact O-CB 3.5Å; H155-A158 PolarHBondContact O-N 3.26Å; H155-A158 VanDerWaalsContact O-N 3.16Å
156	S	53.5	Low	61.4	Low	23 Å²	23	98.9 Å²	98.9	16%	0.161	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-61.3	-30.1	172.7	72.1	0	0	0	0	111.8	D154 H159	D154-S156 PolarHBondContact O-N 3.48Å; D154-S156 VanDerWaalsContact O-N 3.09Å; D154-S156 WeakPolarHBondContact OD1-CB 3.34Å; D154-S156 PolarHBondContact OD1-N 3.04Å; D154-S156 PolarHBondContact OD1-OG 3.43Å; D154-S156 PolarHBondContact OD2-OG 3.48Å; S156-H159 PolarHBondContact O-CE1 2.73Å; S156-H159 PolarHBondContact O-ND1 2.99Å
157	K	61.4	Low	63.6	Low	83 Å²	83	94.1 Å²	94.1	36%	0.361	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-90.8	-3.4	179.8	-64.4	173.3	-174.6	153.8	0	113.4	D154 H155 H159 F160 Y163	D154-K157 HydrophobicContact CB-CD 4.3Å; D154-K157 PolarHBondContact O-N 3.28Å; D154-K157 VanDerWaalsContact OD2-CD 3.31Å; D154-K157 WeakPolarHBondContact OD2-CD 3.27Å; D154-K157 WeakPolarHBondContact OD2-CE 3.4Å; D154-K157 IonicContact OD2-NZ 2.79Å; D154-K157 PolarHBondContact OD2-NZ 3.45Å; D154-K157 VanDerWaalsContact OD2-NZ 3.11Å; H155-K157 PolarHBondContact O-N 2.94Å; K157-H159 PolarHBondContact O-N 3.45Å; K157-F160 HydrophobicContact CB-CD2 4.24Å; K157-F160 HydrophobicContact CB-CE2 4.21Å; K157-F160 HydrophobicContact CD-CE2 4.48Å; K157-F160 HydrophobicContact CG-CE2 4.03Å; K157-F160 HydrophobicContact CG-CZ 4.25Å; K157-F160 WeakPolarHBondContact O-CB 3.09Å; K157-F160 WeakPolarHBondContact O-CG 3.32Å; K157-F160 PolarHBondContact O-N 3.09Å; K157-F160 VanDerWaalsContact O-N 3.09Å; K157-Y163 HydrophobicContact CB-CE2 4.08Å; K157-Y163 WeakPolarHBondContact O-CD2 2.83Å; K157-Y163 WeakPolarHBondContact O-CE2 3.31Å
158	A	67.6	Low	66.4	Low	46 Å²	46	91.5 Å²	91.5	38%	0.38	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-29.9	-177.2	0	0	0	0	0	113.5	F153 H155 F160	F153-A158 HydrophobicContact CE1-CB 3.75Å; F153-A158 HydrophobicContact CZ-CB 4.43Å; H155-A158 WeakPolarHBondContact O-CB 3.5Å; H155-A158 PolarHBondContact O-N 3.26Å; H155-A158 VanDerWaalsContact O-N 3.16Å; A158-F160 VanDerWaalsContact C-N 3.27Å; A158-F160 PolarHBondContact O-N 3.35Å
159	H	67.7	Low	69.3	Low	88 Å²	88	84 Å²	84	41%	0.407	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-7.3	-176.8	69.2	-79.4	0	0	0	114.9	K108 S156 K157	K108-H159 PolarHBondContact NZ-CE1 3.43Å; K108-H159 PolarHBondContact NZ-NE2 3.43Å; S156-H159 PolarHBondContact O-CE1 2.73Å; S156-H159 PolarHBondContact O-ND1 2.99Å; K157-H159 PolarHBondContact O-N 3.45Å
160	F	74.1	Confident	72.2	Confident	87 Å²	87	78.6 Å²	78.6	38%	0.382	38%	0.379	S	S	.	.	S	Bend	trans	-71.1	140.9	-177.3	-70.6	-0.4	0	0	0	112.3	K157 A158 R162 Y163	K157-F160 HydrophobicContact CB-CD2 4.24Å; K157-F160 HydrophobicContact CB-CE2 4.21Å; K157-F160 HydrophobicContact CD-CE2 4.48Å; K157-F160 HydrophobicContact CG-CE2 4.03Å; K157-F160 HydrophobicContact CG-CZ 4.25Å; K157-F160 WeakPolarHBondContact O-CB 3.09Å; K157-F160 WeakPolarHBondContact O-CG 3.32Å; K157-F160 PolarHBondContact O-N 3.09Å; K157-F160 VanDerWaalsContact O-N 3.09Å; A158-F160 VanDerWaalsContact C-N 3.27Å; A158-F160 PolarHBondContact O-N 3.35Å; F160-R162 HydrophobicContact CB-CG 4.14Å; F160-R162 PolarHBondContact O-N 3.25Å; F160-Y163 HydrophobicContact CB-CD2 3.97Å; F160-Y163 HydrophobicContact CB-CE2 4.4Å; F160-Y163 PolarHBondContact O-N 3.04Å
161	Y	82.1	Confident	74.9	Confident	137 Å²	137	69.7 Å²	69.7	54%	0.537	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-55.9	-24.4	-177.7	-61.8	-70.2	0	0	0	115.2	Y163 D164 R199	Y161-Y163 PolarHBondContact O-N 2.97Å; Y161-D164 WeakPolarHBondContact CA-OD2 3.35Å; Y161-D164 WeakPolarHBondContact CD1-OD2 3.18Å; Y161-D164 WeakPolarHBondContact O-CB 3.33Å; Y161-D164 PolarHBondContact O-N 3.29Å; Y161-R199 HydrophobicContact CD1-CB 4.45Å; Y161-R199 HydrophobicContact CE1-CB 4.39Å
162	R	82	Confident	77.3	Confident	150 Å²	150	67.9 Å²	67.9	57%	0.566	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-66	-20.3	177.1	68.6	179	172.2	101.5	-0.7	113.7	F160	F160-R162 HydrophobicContact CB-CG 4.14Å; F160-R162 PolarHBondContact O-N 3.25Å
163	Y	79.5	Confident	79.3	Confident	82 Å²	82	65.5 Å²	65.5	32%	0.322	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-100.6	-3.8	179.2	-59.9	-58.3	0	0	0	113.1	F153 K157 F160 Y161	F153-Y163 HydrophobicContact CD2-CE1 4.39Å; F153-Y163 AromaticContact CE2-CD1 3.81Å; F153-Y163 HydrophobicContact CE2-CD1 3.81Å; F153-Y163 HydrophobicContact CE2-CD2 4.45Å; F153-Y163 AromaticContact CE2-CE1 3.25Å; F153-Y163 HydrophobicContact CE2-CE1 3.25Å; F153-Y163 AromaticContact CE2-CE2 3.97Å; F153-Y163 HydrophobicContact CE2-CE2 3.97Å; F153-Y163 HydrophobicContact CE2-CG 4.31Å; F153-Y163 AromaticContact CE2-CZ 3.23Å; F153-Y163 VanDerWaalsContact CE2-OH 3.29Å; F153-Y163 WeakPolarHBondContact CE2-OH 3.27Å; F153-Y163 AromaticContact CZ-CD1 3.95Å; F153-Y163 HydrophobicContact CZ-CD1 3.95Å; F153-Y163 AromaticContact CZ-CD2 3.86Å; F153-Y163 HydrophobicContact CZ-CD2 3.86Å; F153-Y163 AromaticContact CZ-CE1 3.67Å; F153-Y163 HydrophobicContact CZ-CE1 3.67Å; F153-Y163 AromaticContact CZ-CE2 3.58Å; F153-Y163 HydrophobicContact CZ-CE2 3.58Å; F153-Y163 AromaticContact CZ-CG 3.96Å; F153-Y163 HydrophobicContact CZ-CG 3.96Å; F153-Y163 AromaticContact CZ-CZ 3.36Å; K157-Y163 HydrophobicContact CB-CE2 4.08Å; K157-Y163 WeakPolarHBondContact O-CD2 2.83Å; K157-Y163 WeakPolarHBondContact O-CE2 3.31Å; F160-Y163 HydrophobicContact CB-CD2 3.97Å; F160-Y163 HydrophobicContact CB-CE2 4.4Å; F160-Y163 PolarHBondContact O-N 3.04Å; Y161-Y163 PolarHBondContact O-N 2.97Å
164	D	83.3	Confident	80.7	Confident	27 Å²	27	64.4 Å²	64.4	14%	0.144	30%	0.296	C	S	.	.	S	Bend	trans	-63.8	153.4	172.7	-66.3	-28.3	0	0	0	110	Y161 Q166 S197 R199	Y161-D164 WeakPolarHBondContact CA-OD2 3.35Å; Y161-D164 WeakPolarHBondContact CD1-OD2 3.18Å; Y161-D164 WeakPolarHBondContact O-CB 3.33Å; Y161-D164 PolarHBondContact O-N 3.29Å; D164-Q166 PolarHBondContact O-N 2.94Å; D164-Q166 PolarHBondContact O-NE2 2.88Å; D164-S197 VanDerWaalsContact CB-OG 3.27Å; D164-S197 WeakPolarHBondContact CB-OG 3.37Å; D164-S197 VanDerWaalsContact CG-OG 3.31Å; D164-S197 WeakPolarHBondContact OD2-CB 3.48Å; D164-S197 PolarHBondContact OD2-OG 2.79Å; D164-R199 IonicContact OD1-CZ 3.27Å; D164-R199 IonicContact OD1-NH1 2.66Å; D164-R199 PolarHBondContact OD1-NH1 3.35Å; D164-R199 WeakPolarHBondContact OD2-CD 3.2Å; D164-R199 IonicContact OD2-CZ 2.76Å; D164-R199 IonicContact OD2-NE 3.97Å; D164-R199 IonicContact OD2-NH1 3.66Å; D164-R199 PolarHBondContact OD2-NH1 3.47Å
165	E	85.5	Confident	81.1	Confident	121 Å²	121	67.5 Å²	67.5	57%	0.565	32%	0.321	S	S	*	.			trans	-47.8	138.3	161.5	-175.2	-173.5	-174.3	0	0	109.9	S197 V198 K236	E165-S197 WeakPolarHBondContact O-CA 3.43Å; E165-V198 HydrophobicContact CB-CG1 3.96Å; E165-V198 HydrophobicContact CB-CG2 3.96Å; E165-V198 HydrophobicContact CG-CG1 3.86Å; E165-V198 WeakPolarHBondContact O-CG1 3.29Å; E165-V198 PolarHBondContact O-N 2.94Å; E165-K236 IonicContact OE2-NZ 3.33Å; E165-K236 PolarHBondContact OE2-NZ 3.11Å
166	Q	92.2	Very high	80.9	Confident	82 Å²	82	66.3 Å²	66.3	38%	0.383	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	140.8	-176.3	-60	-65.5	-55.4	0	0	110.8	D164 R195 C196	D164-Q166 PolarHBondContact O-N 2.94Å; D164-Q166 PolarHBondContact O-NE2 2.88Å; Q166-R195 HydrophobicContact CB-CG 3.85Å; Q166-R195 HydrophobicContact CG-CG 4.47Å; Q166-C196 CarbonylContact C-O 3.45Å; Q166-C196 WeakPolarHBondContact CA-O 3.45Å; Q166-C196 PolarHBondContact OE1-O 2.91Å
167	V	93.6	Very high	80.8	Confident	11 Å²	11	70.1 Å²	70.1	7%	0.067	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.4	173.9	65.6	0	0	0	0	110.2	L169 R195 C196 V198 M235 W239	V167-L169 HydrophobicContact CG1-CD2 4.12Å; V167-L169 HydrophobicContact CG1-CG 4.36Å; V167-L169 HydrophobicContact CG2-CD2 4.01Å; V167-R195 WeakPolarHBondContact O-CA 3.28Å; V167-C196 PolarHBondContact N-O 2.78Å; V167-C196 PolarHBondContact O-N 2.59Å; V167-C196 VanDerWaalsContact O-N 3.14Å; V167-V198 HydrophobicContact CB-CG1 4.19Å; V167-M235 HydrophobicContact CG1-CB 3.59Å; V167-M235 HydrophobicContact CG1-CG 4.06Å; V167-W239 HydrophobicContact CG2-CD2 4.34Å; V167-W239 HydrophobicContact CG2-CE3 3.4Å; V167-W239 HydrophobicContact CG2-CZ3 3.64Å
168	S	96.3	Very high	80	Confident	19 Å²	19	73.1 Å²	73.1	13%	0.133	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.5	176.8	-54.2	0	0	0	0	109.9	R195 P249 L250	S168-R195 PolarHBondContact OG-NE 3.14Å; S168-R195 PolarHBondContact OG-NH2 3.45Å; S168-P249 WeakPolarHBondContact O-CA 3.44Å; S168-P249 WeakPolarHBondContact O-CB 3.45Å; S168-L250 PolarHBondContact O-N 3.21Å
169	L	96	Very high	79.1	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.9	-173.7	-51.7	176.6	0	0	0	110.6	V167 F193 V194 L205 M235 L250	V167-L169 HydrophobicContact CG1-CD2 4.12Å; V167-L169 HydrophobicContact CG1-CG 4.36Å; V167-L169 HydrophobicContact CG2-CD2 4.01Å; L169-F193 CarbonylContact O-C 3.55Å; L169-F193 VanDerWaalsContact O-CA 3.26Å; L169-F193 WeakPolarHBondContact O-CA 3.28Å; L169-V194 HydrophobicContact CB-CB 4.42Å; L169-V194 PolarHBondContact N-O 3.38Å; L169-V194 PolarHBondContact O-N 3.38Å; L169-L205 HydrophobicContact CD1-CD1 3.66Å; L169-L205 HydrophobicContact CD1-CD2 3.95Å; L169-L205 HydrophobicContact CD1-CG 4.44Å; L169-M235 HydrophobicContact CD1-CG 4.15Å; L169-M235 HydrophobicContact CD1-SD 3.63Å; L169-M235 HydrophobicContact CD2-SD 4.16Å; L169-L250 CarbonylContact C-O 3.55Å; L169-L250 VanDerWaalsContact CA-O 3.27Å; L169-L250 WeakPolarHBondContact CA-O 3.15Å; L169-L250 HydrophobicContact CD2-CB 3.83Å; L169-L250 HydrophobicContact CD2-CD2 3.8Å; L169-L250 HydrophobicContact CD2-CG 4.02Å
170	C	95.4	Very high	78.1	Confident	4 Å²	4	74.9 Å²	74.9	3%	0.027	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.1	165	-173.2	0	0	0	0	109	K192 F193 P249 L250 V251 L252	C170-K192 CarbonylContact C-O 3.57Å; C170-K192 WeakPolarHBondContact CA-O 3.48Å; C170-F193 HydrophobicContact CB-CD1 4.02Å; C170-F193 HydrophobicContact CB-CE1 3.87Å; C170-P249 HydrophobicContact CB-CB 4.46Å; C170-P249 HydrophobicContact CB-CG 4.05Å; C170-L250 PolarHBondContact N-O 3.32Å; C170-V251 HydrophobicContact CB-CG1 4.5Å; C170-V251 HydrophobicContact CB-CG2 4.19Å; C170-V251 WeakPolarHBondContact O-CA 3.45Å; C170-L252 PolarHBondContact O-N 3.02Å
171	L	95	Very high	76.7	Confident	2 Å²	2	80.9 Å²	80.9	1%	0.01	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	107	179.4	-57.5	-176.6	0	0	0	110	L189 K192 V194 L205 L209 M222 L252 Y254	L171-L189 HydrophobicContact CB-CD1 3.85Å; L171-L189 HydrophobicContact CD1-CD1 4.13Å; L171-K192 PolarHBondContact N-O 3.37Å; L171-V194 HydrophobicContact CD1-CG2 3.83Å; L171-V194 HydrophobicContact CG-CG2 4.31Å; L171-L205 HydrophobicContact CD2-CD1 4.44Å; L171-L209 HydrophobicContact CD1-CD2 4.27Å; L171-L209 HydrophobicContact CD1-CG 4.41Å; L171-M222 HydrophobicContact CD2-CE 3.93Å; L171-L252 WeakPolarHBondContact CA-O 3.46Å; L171-L252 HydrophobicContact CD2-CB 3.96Å; L171-L252 HydrophobicContact CD2-CD1 4.26Å; L171-L252 HydrophobicContact CD2-CG 4.5Å; L171-Y254 HydrophobicContact CB-CD1 4.44Å; L171-Y254 HydrophobicContact CB-CE1 4.49Å
172	E	91.9	Very high	75	Confident	75 Å²	75	83.7 Å²	83.7	35%	0.35	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.1	-177.9	-62.9	-167.2	171.6	0	0	111.9	Q174 V251 L252 H253 Y254	E172-Q174 PolarHBondContact O-N 3.45Å; E172-V251 HydrophobicContact CG-CG1 4.14Å; E172-L252 PolarHBondContact N-O 3.22Å; E172-H253 CarbonylContact O-C 3.56Å; E172-H253 WeakPolarHBondContact O-CA 3.22Å; E172-H253 IonicContact OE2-NE2 3.11Å; E172-Y254 VanDerWaalsContact C-CE1 3.47Å; E172-Y254 WeakPolarHBondContact O-CD1 3.42Å; E172-Y254 PolarHBondContact O-N 2.85Å
173	R	90.1	Very high	73.6	Confident	74 Å²	74	82.3 Å²	82.3	28%	0.279	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	124.8	173.1	-171.8	176	-178.8	-179	4.2	108.4	S175 K184 L187 T188 Y254	R173-S175 PolarHBondContact O-N 3.44Å; R173-K184 PolarHBondContact NH1-O 3.06Å; R173-K184 VanDerWaalsContact NH1-O 3.14Å; R173-L187 VanDerWaalsContact NH1-CB 3.33Å; R173-L187 PolarHBondContact NH1-O 3.29Å; R173-T188 PolarHBondContact NH1-OG1 2.96Å; R173-Y254 WeakPolarHBondContact CA-O 3.43Å; R173-Y254 HydrophobicContact CB-CE1 4.07Å; R173-Y254 HydrophobicContact CB-CE2 4.2Å; R173-Y254 HydrophobicContact CG-CE2 4.2Å
174	Q	84.8	Confident	72.3	Confident	54 Å²	54	83 Å²	83	25%	0.252	44%	0.442	S	S	.	.			trans	-68.7	122.6	172.6	-169	171	22.7	0	0	109	E172 L176 N226 H253 Y254 T255	E172-Q174 PolarHBondContact O-N 3.45Å; Q174-L176 PolarHBondContact O-N 2.92Å; Q174-N226 PolarHBondContact NE2-OD1 3.44Å; Q174-H253 HydrophobicContact CB-CB 4.4Å; Q174-Y254 PolarHBondContact N-O 2.6Å; Q174-T255 HydrophobicContact CB-CG2 3.76Å
175	S	68.3	Low	71.1	Confident	104 Å²	104	86.8 Å²	86.8	73%	0.727	47%	0.466	S	S	*	.			trans	-71.8	110.3	-178.3	-173.8	0	0	0	0	110	R173	R173-S175 PolarHBondContact O-N 3.44Å
176	L	59.3	Low	70	Confident	124 Å²	124	89.1 Å²	89.1	65%	0.649	47%	0.474	S	S	*	.			trans	-90.6	111.1	164.8	-68.9	166.2	0	0	0	107.8	Q174 L178 T255	Q174-L176 PolarHBondContact O-N 2.92Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 PolarHBondContact O-N 2.89Å; L176-T255 HydrophobicContact CD1-CG2 4.49Å
177	S	49.8	Very low	69	Low	102 Å²	102	86.8 Å²	86.8	71%	0.713	46%	0.464	S	S	*	.			trans	-77.2	76.1	177.7	55.2	0	0	0	0	110.9
178	L	46.5	Very low	68.4	Low	146 Å²	146	88.2 Å²	88.2	76%	0.764	47%	0.473	S	S	*	.			trans	-138	142.6	158.8	-71.2	172.7	0	0	0	110.4	L176	L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 PolarHBondContact O-N 2.89Å
179	S	47.7	Very low	67.5	Low	122 Å²	122	88 Å²	88	85%	0.853	47%	0.47	S	S	*	.	S	Bend	trans	-22.1	131.8	179.8	54.2	0	0	0	0	118.4
180	G	45.8	Very low	66.7	Low	50 Å²	50	95.9 Å²	95.9	52%	0.515	51%	0.507	S	S	.	.			trans	136.7	88	163.9	0	0	0	0	0	113.4	K182	G180-K182 PolarHBondContact O-N 3.43Å
181	K	46.2	Very low	66.2	Low	213 Å²	213	102.4 Å²	102.4	93%	0.926	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	0.9	-174.8	-87.8	180	176.1	175.8	0	115.4
182	K	46.5	Very low	66	Low	195 Å²	195	106.1 Å²	106.1	85%	0.848	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-24.9	-171.3	-87.1	-177.3	172.6	178.9	0	116.6	G180	G180-K182 PolarHBondContact O-N 3.43Å
183	D	51	Low	66.1	Low	121 Å²	121	109.7 Å²	109.7	65%	0.647	57%	0.568	S	S	*	*	S	Bend	trans	-112.2	0.5	-174.4	-83.4	-49.5	0	0	0	116.1	T185	D183-T185 VanDerWaalsContact C-N 3.3Å; D183-T185 PolarHBondContact O-N 2.98Å
184	K	53.9	Low	66.3	Low	97 Å²	97	107.8 Å²	107.8	42%	0.422	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.3	-25.7	-174.2	-73.3	-170.7	176.4	-172.1	0	114.3	R173 T188	R173-K184 PolarHBondContact NH1-O 3.06Å; R173-K184 VanDerWaalsContact NH1-O 3.14Å; K184-T188 PolarHBondContact O-OG1 3.32Å
185	T	57	Low	66.8	Low	106 Å²	106	113.7 Å²	113.7	65%	0.65	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-35.2	-175.6	45.5	0	0	0	0	113.4	D183 L187 T188	D183-T185 VanDerWaalsContact C-N 3.3Å; D183-T185 PolarHBondContact O-N 2.98Å; T185-L187 VanDerWaalsContact C-N 3.33Å; T185-L187 PolarHBondContact O-N 3.19Å; T185-T188 PolarHBondContact O-N 3.12Å
186	K	63.8	Low	68.1	Low	170 Å²	170	109.7 Å²	109.7	74%	0.739	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-30.4	-176	-168.7	175.3	179.9	-179.5	0	113.4
187	L	71.1	Confident	69.8	Low	33 Å²	33	104.3 Å²	104.3	17%	0.173	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	18.9	-175.8	-70.9	-177.8	0	0	0	113.3	R173 T185 V215 I256	R173-L187 VanDerWaalsContact NH1-CB 3.33Å; R173-L187 PolarHBondContact NH1-O 3.29Å; T185-L187 VanDerWaalsContact C-N 3.33Å; T185-L187 PolarHBondContact O-N 3.19Å; L187-V215 HydrophobicContact CD2-CG1 3.85Å; L187-I256 HydrophobicContact CB-CD1 3.79Å; L187-I256 HydrophobicContact CD1-CD1 4.44Å; L187-I256 HydrophobicContact CD1-CG2 4.4Å; L187-I256 HydrophobicContact CD2-CD1 3.86Å; L187-I256 HydrophobicContact CG-CD1 4.22Å
188	T	79.2	Confident	71.7	Confident	41 Å²	41	100.1 Å²	100.1	25%	0.252	50%	0.499	S	S	.	.	S	Bend	trans	-116.3	127.2	177.4	-56.6	0	0	0	0	109.3	R173 K184 T185 Q190	R173-T188 PolarHBondContact NH1-OG1 2.96Å; K184-T188 PolarHBondContact O-OG1 3.32Å; T185-T188 PolarHBondContact O-N 3.12Å; T188-Q190 PolarHBondContact O-N 3.49Å
189	L	79.3	Confident	73.9	Confident	15 Å²	15	96.4 Å²	96.4	8%	0.079	48%	0.475	C	S	.	.			trans	-56.2	121.4	172.8	-89.3	166.2	0	0	0	111	L171 K192 L209 R212 L213 Y254	L171-L189 HydrophobicContact CB-CD1 3.85Å; L171-L189 HydrophobicContact CD1-CD1 4.13Å; L189-K192 HydrophobicContact CB-CG 4.36Å; L189-K192 WeakPolarHBondContact O-CG 3.42Å; L189-L209 HydrophobicContact CD1-CD2 3.23Å; L189-L209 HydrophobicContact CG-CD2 3.96Å; L189-R212 HydrophobicContact CD2-CB 3.93Å; L189-R212 HydrophobicContact CD2-CG 4.33Å; L189-L213 HydrophobicContact CG-CD2 4.3Å; L189-Y254 HydrophobicContact CD1-CE1 3.91Å; L189-Y254 PolarHBondContact N-OH 2.79Å
190	Q	78.9	Confident	76.2	Confident	165 Å²	165	91.4 Å²	91.4	77%	0.771	44%	0.441	S	S	*	.	S	Bend	trans	-70	-43.3	170.2	-60.3	-61	-29.4	0	0	110.5	T188	T188-Q190 PolarHBondContact O-N 3.49Å
191	Q	84.6	Confident	78.5	Confident	141 Å²	141	89.9 Å²	89.9	66%	0.659	42%	0.42	S	S	*	.			trans	-100.4	99.3	174.1	-69	177.8	-17.8	0	0	109.7
192	K	90.3	Very high	80.8	Confident	81 Å²	81	79.7 Å²	79.7	35%	0.352	38%	0.376	S	S	.	.			trans	-85.2	-19.7	-175.9	-59.5	-178.7	-174.2	176.7	0	113.4	C170 L171 L189	C170-K192 CarbonylContact C-O 3.57Å; C170-K192 WeakPolarHBondContact CA-O 3.48Å; L171-K192 PolarHBondContact N-O 3.37Å; L189-K192 HydrophobicContact CB-CG 4.36Å; L189-K192 WeakPolarHBondContact O-CG 3.42Å
193	F	94.8	Very high	83.1	Confident	149 Å²	149	74.9 Å²	74.9	65%	0.654	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.8	-175.7	-60	-81.1	0	0	0	111.4	L169 C170 P249	L169-F193 CarbonylContact O-C 3.55Å; L169-F193 VanDerWaalsContact O-CA 3.26Å; L169-F193 WeakPolarHBondContact O-CA 3.28Å; C170-F193 HydrophobicContact CB-CD1 4.02Å; C170-F193 HydrophobicContact CB-CE1 3.87Å; F193-P249 HydrophobicContact CD1-CG 4.14Å; F193-P249 HydrophobicContact CE1-CG 3.87Å
194	V	94.3	Very high	85.2	Confident	35 Å²	35	72.4 Å²	72.4	21%	0.212	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.6	179.1	179	0	0	0	0	108.6	L169 L171 L205	L169-V194 HydrophobicContact CB-CB 4.42Å; L169-V194 PolarHBondContact N-O 3.38Å; L169-V194 PolarHBondContact O-N 3.38Å; L171-V194 HydrophobicContact CD1-CG2 3.83Å; L171-V194 HydrophobicContact CG-CG2 4.31Å; V194-L205 HydrophobicContact CG1-CD2 4.29Å
195	R	95.5	Very high	87.2	Confident	178 Å²	178	68 Å²	68	67%	0.672	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	130.4	166.7	-175	173.2	-72.6	164.7	-2.4	108.8	Q166 V167 S168	Q166-R195 HydrophobicContact CB-CG 3.85Å; Q166-R195 HydrophobicContact CG-CG 4.47Å; V167-R195 WeakPolarHBondContact O-CA 3.28Å; S168-R195 PolarHBondContact OG-NE 3.14Å; S168-R195 PolarHBondContact OG-NH2 3.45Å
196	C	94.9	Very high	88.9	Confident	20 Å²	20	64.5 Å²	64.5	14%	0.135	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	167.9	-179.3	62.8	0	0	0	0	111.8	Q166 V167 A200	Q166-C196 CarbonylContact C-O 3.45Å; Q166-C196 WeakPolarHBondContact CA-O 3.45Å; Q166-C196 PolarHBondContact OE1-O 2.91Å; V167-C196 PolarHBondContact N-O 2.78Å; V167-C196 PolarHBondContact O-N 2.59Å; V167-C196 VanDerWaalsContact O-N 3.14Å; C196-A200 HydrophobicContact CB-CB 4.15Å
197	S	94.6	Very high	90.3	Very high	11 Å²	11	62.4 Å²	62.4	8%	0.077	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	141.6	170.4	160.4	0	0	0	0	111	D164 E165 R199 A200	D164-S197 VanDerWaalsContact CB-OG 3.27Å; D164-S197 WeakPolarHBondContact CB-OG 3.37Å; D164-S197 VanDerWaalsContact CG-OG 3.31Å; D164-S197 WeakPolarHBondContact OD2-CB 3.48Å; D164-S197 PolarHBondContact OD2-OG 2.79Å; E165-S197 WeakPolarHBondContact O-CA 3.43Å; S197-R199 PolarHBondContact O-N 2.89Å; S197-R199 WeakPolarHBondContact OG-CB 3.35Å; S197-R199 PolarHBondContact OG-N 3.31Å; S197-A200 WeakPolarHBondContact O-CB 3.36Å; S197-A200 PolarHBondContact O-N 3.34Å
198	V	90.4	Very high	91.4	Very high	14 Å²	14	63.9 Å²	63.9	9%	0.085	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.6	170.9	-69.4	0	0	0	0	113.4	E165 V167 M235 K236	E165-V198 HydrophobicContact CB-CG1 3.96Å; E165-V198 HydrophobicContact CB-CG2 3.96Å; E165-V198 HydrophobicContact CG-CG1 3.86Å; E165-V198 WeakPolarHBondContact O-CG1 3.29Å; E165-V198 PolarHBondContact O-N 2.94Å; V167-V198 HydrophobicContact CB-CG1 4.19Å; V198-M235 PolarHBondContact O-N 3.48Å; V198-K236 HydrophobicContact CB-CB 4.03Å; V198-K236 HydrophobicContact CB-CD 3.99Å; V198-K236 HydrophobicContact CB-CG 4.44Å; V198-K236 HydrophobicContact CG1-CD 4.49Å; V198-K236 HydrophobicContact CG2-CD 3.99Å; V198-K236 PolarHBondContact O-N 3.44Å
199	R	92.4	Very high	92	Very high	68 Å²	68	62 Å²	62	26%	0.257	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.1	174.9	-69.1	164.1	59.1	-152.4	4.4	113	Y161 D164 S197	Y161-R199 HydrophobicContact CD1-CB 4.45Å; Y161-R199 HydrophobicContact CE1-CB 4.39Å; D164-R199 IonicContact OD1-CZ 3.27Å; D164-R199 IonicContact OD1-NH1 2.66Å; D164-R199 PolarHBondContact OD1-NH1 3.35Å; D164-R199 WeakPolarHBondContact OD2-CD 3.2Å; D164-R199 IonicContact OD2-CZ 2.76Å; D164-R199 IonicContact OD2-NE 3.97Å; D164-R199 IonicContact OD2-NH1 3.66Å; D164-R199 PolarHBondContact OD2-NH1 3.47Å; S197-R199 PolarHBondContact O-N 2.89Å; S197-R199 WeakPolarHBondContact OG-CB 3.35Å; S197-R199 PolarHBondContact OG-N 3.31Å
200	A	94.8	Very high	92.7	Very high	17 Å²	17	62.1 Å²	62.1	14%	0.14	29%	0.285	C	S	.	.			trans	-58.3	151	170.8	0	0	0	0	0	110.4	C196 S197 T234 M235	C196-A200 HydrophobicContact CB-CB 4.15Å; S197-A200 WeakPolarHBondContact O-CB 3.36Å; S197-A200 PolarHBondContact O-N 3.34Å; A200-T234 CarbonylContact O-C 3.57Å; A200-T234 VanDerWaalsContact O-CA 3.23Å; A200-T234 WeakPolarHBondContact O-CA 3.38Å; A200-M235 HydrophobicContact CB-CG 4.29Å; A200-M235 WeakPolarHBondContact O-CG 3.45Å; A200-M235 PolarHBondContact O-N 3.36Å
201	E	95.1	Very high	93.3	Very high	17 Å²	17	61.4 Å²	61.4	8%	0.079	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-120.3	161.8	-173.7	-64.1	169.4	-136.4	0	0	110.4	R203 H204 L205 H232 M233 T234	E201-R203 HydrophobicContact CB-CG 3.99Å; E201-R203 PolarHBondContact O-N 3.09Å; E201-R203 IonicContact OE1-CZ 3.88Å; E201-R203 IonicContact OE1-NE 3.39Å; E201-R203 IonicContact OE1-NH2 2.73Å; E201-R203 PolarHBondContact OE1-NH2 3.21Å; E201-R203 IonicContact OE2-CZ 2.66Å; E201-R203 IonicContact OE2-NE 3.43Å; E201-R203 PolarHBondContact OE2-NE 2.94Å; E201-R203 IonicContact OE2-NH2 3.7Å; E201-R203 PolarHBondContact OE2-NH2 3.45Å; E201-H204 WeakPolarHBondContact CB-ND1 3.34Å; E201-H204 PolarHBondContact N-ND1 2.98Å; E201-H204 VanDerWaalsContact N-ND1 3.11Å; E201-H204 WeakPolarHBondContact O-CA 3.49Å; E201-H204 VanDerWaalsContact O-CB 3.29Å; E201-H204 WeakPolarHBondContact O-CB 3.34Å; E201-H204 PolarHBondContact O-N 2.98Å; E201-H204 IonicContact OE1-CE1 3.64Å; E201-L205 PolarHBondContact O-N 3.28Å; E201-H232 WeakPolarHBondContact OE2-CA 3.44Å; E201-M233 VanDerWaalsContact CA-O 3.3Å; E201-M233 WeakPolarHBondContact CA-O 3.37Å; E201-T234 HydrophobicContact CG-CG2 3.92Å
202	V	94.9	Very high	93.5	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-54.2	-39.1	177.8	173.5	0	0	0	0	111.6	H204 L205 R206 M222 L229 P230 D231 M233 M235 L238	V202-H204 PolarHBondContact O-N 3.08Å; V202-L205 PolarHBondContact O-N 3.29Å; V202-L205 VanDerWaalsContact O-N 3.15Å; V202-R206 HydrophobicContact CG1-CG 4.37Å; V202-R206 WeakPolarHBondContact O-CG 3.32Å; V202-R206 PolarHBondContact O-N 3.48Å; V202-M222 HydrophobicContact CG1-CB 4.01Å; V202-M222 HydrophobicContact CG1-CG 4.42Å; V202-M222 HydrophobicContact CG1-SD 3.92Å; V202-L229 HydrophobicContact CG1-CB 4.05Å; V202-L229 HydrophobicContact CG2-CB 3.9Å; V202-L229 HydrophobicContact CG2-CD1 4.21Å; V202-P230 WeakPolarHBondContact CB-O 3.36Å; V202-P230 WeakPolarHBondContact CG2-O 3.31Å; V202-D231 PolarHBondContact N-O 3.13Å; V202-M233 HydrophobicContact CG2-CB 4.12Å; V202-M233 WeakPolarHBondContact CG2-O 3.25Å; V202-M233 PolarHBondContact N-O 2.89Å; V202-M235 HydrophobicContact CG2-CE 3.9Å; V202-L238 HydrophobicContact CG2-CD1 4.01Å
203	R	94.1	Very high	93.5	Very high	94 Å²	94	59.2 Å²	59.2	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-58.2	-32.8	174.9	63.2	174.8	169.9	130.4	4.3	113.6	E201 K207 D231	E201-R203 HydrophobicContact CB-CG 3.99Å; E201-R203 PolarHBondContact O-N 3.09Å; E201-R203 IonicContact OE1-CZ 3.88Å; E201-R203 IonicContact OE1-NE 3.39Å; E201-R203 IonicContact OE1-NH2 2.73Å; E201-R203 PolarHBondContact OE1-NH2 3.21Å; E201-R203 IonicContact OE2-CZ 2.66Å; E201-R203 IonicContact OE2-NE 3.43Å; E201-R203 PolarHBondContact OE2-NE 2.94Å; E201-R203 IonicContact OE2-NH2 3.7Å; E201-R203 PolarHBondContact OE2-NH2 3.45Å; R203-K207 WeakPolarHBondContact O-CG 3.3Å; R203-K207 PolarHBondContact O-N 3.16Å; R203-D231 HydrophobicContact CB-CB 4.01Å; R203-D231 PolarHBondContact N-O 3.25Å
204	H	95.4	Very high	93.2	Very high	69 Å²	69	59.5 Å²	59.5	32%	0.319	27%	0.274	S	S	.	.	H	α-helix	trans	-71.8	-43.2	178	-59.6	113.2	0	0	0	110.5	E201 V202 R206 K207 V208	E201-H204 WeakPolarHBondContact CB-ND1 3.34Å; E201-H204 PolarHBondContact N-ND1 2.98Å; E201-H204 VanDerWaalsContact N-ND1 3.11Å; E201-H204 WeakPolarHBondContact O-CA 3.49Å; E201-H204 VanDerWaalsContact O-CB 3.29Å; E201-H204 WeakPolarHBondContact O-CB 3.34Å; E201-H204 PolarHBondContact O-N 2.98Å; E201-H204 IonicContact OE1-CE1 3.64Å; V202-H204 PolarHBondContact O-N 3.08Å; H204-R206 PolarHBondContact O-N 2.77Å; H204-K207 WeakPolarHBondContact O-CB 3.43Å; H204-K207 PolarHBondContact O-N 3.48Å; H204-V208 WeakPolarHBondContact O-CG2 3.31Å; H204-V208 PolarHBondContact O-N 3.47Å; H204-V208 VanDerWaalsContact O-N 3.08Å
205	L	94.9	Very high	93	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-40.6	173.9	-62	-176.4	0	0	0	112.1	L169 L171 V194 E201 V202 K207 V208 L209 M222 M235 L252	L169-L205 HydrophobicContact CD1-CD1 3.66Å; L169-L205 HydrophobicContact CD1-CD2 3.95Å; L169-L205 HydrophobicContact CD1-CG 4.44Å; L171-L205 HydrophobicContact CD2-CD1 4.44Å; V194-L205 HydrophobicContact CG1-CD2 4.29Å; E201-L205 PolarHBondContact O-N 3.28Å; V202-L205 PolarHBondContact O-N 3.29Å; V202-L205 VanDerWaalsContact O-N 3.15Å; L205-K207 VanDerWaalsContact C-N 3.33Å; L205-K207 PolarHBondContact O-N 3.44Å; L205-V208 WeakPolarHBondContact O-CB 3.27Å; L205-V208 PolarHBondContact O-N 2.99Å; L205-V208 VanDerWaalsContact O-N 3.15Å; L205-L209 WeakPolarHBondContact O-CG 3.36Å; L205-L209 PolarHBondContact O-N 3.04Å; L205-M222 HydrophobicContact CB-CE 3.92Å; L205-M222 HydrophobicContact CB-SD 3.72Å; L205-M222 HydrophobicContact CD1-CE 3.85Å; L205-M235 HydrophobicContact CD1-CE 3.64Å; L205-M235 HydrophobicContact CD1-SD 3.55Å; L205-M235 VanDerWaalsContact CD1-SD 3.55Å; L205-M235 HydrophobicContact CG-CE 4.29Å; L205-M235 HydrophobicContact CG-SD 4.45Å; L205-L252 HydrophobicContact CD1-CD1 3.85Å
206	R	93.6	Very high	92.7	Very high	33 Å²	33	54.7 Å²	54.7	13%	0.125	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-42.8	173	-73.7	-180	64.6	-144.7	5.2	112	V202 H204 V208 L209 C210 K217 V220 M222 D231	V202-R206 HydrophobicContact CG1-CG 4.37Å; V202-R206 WeakPolarHBondContact O-CG 3.32Å; V202-R206 PolarHBondContact O-N 3.48Å; H204-R206 PolarHBondContact O-N 2.77Å; R206-V208 VanDerWaalsContact C-N 3.33Å; R206-V208 PolarHBondContact O-N 3.36Å; R206-L209 WeakPolarHBondContact O-CB 3.5Å; R206-L209 PolarHBondContact O-N 3.32Å; R206-C210 PolarHBondContact O-N 3.43Å; R206-C210 PolarHBondContact O-SG 3.25Å; R206-K217 PolarHBondContact NH2-O 3.35Å; R206-V220 HydrophobicContact CG-CG1 4.26Å; R206-V220 PolarHBondContact NE-O 3.11Å; R206-V220 PolarHBondContact NH2-O 3.24Å; R206-M222 HydrophobicContact CG-CG 3.76Å; R206-M222 HydrophobicContact CG-SD 3.59Å; R206-M222 VanDerWaalsContact CG-SD 3.59Å; R206-D231 VanDerWaalsContact CD-OD1 3.32Å; R206-D231 WeakPolarHBondContact CD-OD1 3.3Å; R206-D231 IonicContact CZ-OD1 3.84Å; R206-D231 IonicContact NE-OD1 2.86Å; R206-D231 IonicContact NH1-OD1 3.62Å; R206-D231 PolarHBondContact NH1-OD1 2.82Å; R206-D231 IonicContact NH1-OD2 2.9Å; R206-D231 PolarHBondContact NH1-OD2 2.71Å
207	K	93.8	Very high	92.3	Very high	126 Å²	126	58.4 Å²	58.4	55%	0.548	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-42.6	174.4	-76.8	-179.1	178	-175.4	0	111.8	R203 H204 L205 C210 H211	R203-K207 WeakPolarHBondContact O-CG 3.3Å; R203-K207 PolarHBondContact O-N 3.16Å; H204-K207 WeakPolarHBondContact O-CB 3.43Å; H204-K207 PolarHBondContact O-N 3.48Å; L205-K207 VanDerWaalsContact C-N 3.33Å; L205-K207 PolarHBondContact O-N 3.44Å; K207-C210 PolarHBondContact O-N 2.92Å; K207-H211 PolarHBondContact O-N 3.38Å
208	V	93.7	Very high	92	Very high	64 Å²	64	63.6 Å²	63.6	39%	0.388	29%	0.294	S	S	.	.	H	α-helix	trans	-61.3	-45.4	175.5	175.2	0	0	0	0	110.9	H204 L205 R206 H211 R212	H204-V208 WeakPolarHBondContact O-CG2 3.31Å; H204-V208 PolarHBondContact O-N 3.47Å; H204-V208 VanDerWaalsContact O-N 3.08Å; L205-V208 WeakPolarHBondContact O-CB 3.27Å; L205-V208 PolarHBondContact O-N 2.99Å; L205-V208 VanDerWaalsContact O-N 3.15Å; R206-V208 VanDerWaalsContact C-N 3.33Å; R206-V208 PolarHBondContact O-N 3.36Å; V208-H211 PolarHBondContact O-N 2.99Å; V208-R212 HydrophobicContact CG1-CG 4.18Å; V208-R212 WeakPolarHBondContact O-CB 3.18Å; V208-R212 VanDerWaalsContact O-CG 3.31Å; V208-R212 WeakPolarHBondContact O-CG 3.16Å; V208-R212 PolarHBondContact O-N 3.28Å
209	L	92.7	Very high	91.9	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-47	175.8	-74.3	167.8	0	0	0	112	L171 L189 L205 R206 H211 R212 L213 V220 M222 Y254	L171-L209 HydrophobicContact CD1-CD2 4.27Å; L171-L209 HydrophobicContact CD1-CG 4.41Å; L189-L209 HydrophobicContact CD1-CD2 3.23Å; L189-L209 HydrophobicContact CG-CD2 3.96Å; L205-L209 WeakPolarHBondContact O-CG 3.36Å; L205-L209 PolarHBondContact O-N 3.04Å; R206-L209 WeakPolarHBondContact O-CB 3.5Å; R206-L209 PolarHBondContact O-N 3.32Å; L209-H211 VanDerWaalsContact C-N 3.31Å; L209-H211 PolarHBondContact O-N 3.39Å; L209-R212 PolarHBondContact O-N 3.44Å; L209-L213 HydrophobicContact CB-CD1 4.47Å; L209-L213 HydrophobicContact CD2-CD1 3.99Å; L209-L213 VanDerWaalsContact O-CB 3.26Å; L209-L213 WeakPolarHBondContact O-CB 3.43Å; L209-L213 WeakPolarHBondContact O-CG 3.47Å; L209-L213 PolarHBondContact O-N 3.16Å; L209-V220 HydrophobicContact CB-CG1 3.98Å; L209-V220 HydrophobicContact CB-CG2 4.48Å; L209-V220 HydrophobicContact CD1-CG1 3.67Å; L209-V220 HydrophobicContact CG-CG1 4.46Å; L209-M222 HydrophobicContact CD1-CE 4.43Å; L209-M222 HydrophobicContact CD1-CG 4.05Å; L209-M222 HydrophobicContact CD1-SD 3.9Å; L209-Y254 HydrophobicContact CD1-CD1 4.45Å; L209-Y254 HydrophobicContact CD1-CD2 4.45Å; L209-Y254 HydrophobicContact CD1-CG 4.03Å; L209-Y254 HydrophobicContact CD2-CD1 4.06Å; L209-Y254 HydrophobicContact CD2-CD2 4.17Å; L209-Y254 HydrophobicContact CD2-CE1 4.11Å; L209-Y254 HydrophobicContact CD2-CE2 4.22Å; L209-Y254 HydrophobicContact CD2-CG 4.1Å
210	C	92.6	Very high	91.9	Very high	18 Å²	18	60.4 Å²	60.4	12%	0.122	28%	0.282	C	S	.	.	H	α-helix	trans	-57	-46.8	178.1	-66.1	0	0	0	0	111.4	R206 K207 N214 V215 K217	R206-C210 PolarHBondContact O-N 3.43Å; R206-C210 PolarHBondContact O-SG 3.25Å; K207-C210 PolarHBondContact O-N 2.92Å; C210-N214 VanDerWaalsContact O-CA 3.31Å; C210-N214 WeakPolarHBondContact O-CA 3.18Å; C210-N214 PolarHBondContact O-N 3.16Å; C210-V215 WeakPolarHBondContact CA-O 3.23Å; C210-V215 VanDerWaalsContact CB-O 3.23Å; C210-V215 WeakPolarHBondContact CB-O 3.39Å; C210-V215 PolarHBondContact O-N 3.43Å; C210-V215 VanDerWaalsContact O-N 3.08Å; C210-K217 VanDerWaalsContact SG-CA 3.53Å
211	H	91.3	Very high	91.8	Very high	149 Å²	149	61.8 Å²	61.8	69%	0.69	29%	0.285	S	S	*	.	H	α-helix	trans	-67.3	-45.3	179.8	-177	69.8	0	0	0	112.3	K207 V208 L209 L213	K207-H211 PolarHBondContact O-N 3.38Å; V208-H211 PolarHBondContact O-N 2.99Å; L209-H211 VanDerWaalsContact C-N 3.31Å; L209-H211 PolarHBondContact O-N 3.39Å; H211-L213 PolarHBondContact O-N 3.4Å
212	R	90.3	Very high	91.7	Very high	161 Å²	161	61.2 Å²	61.2	61%	0.608	28%	0.282	S	S	*	.	H	α-helix	trans	-70.9	-29.7	-177.9	-70.2	-62.8	-168.7	-169.4	2.6	113.6	L189 V208 L209	L189-R212 HydrophobicContact CD2-CB 3.93Å; L189-R212 HydrophobicContact CD2-CG 4.33Å; V208-R212 HydrophobicContact CG1-CG 4.18Å; V208-R212 WeakPolarHBondContact O-CB 3.18Å; V208-R212 VanDerWaalsContact O-CG 3.31Å; V208-R212 WeakPolarHBondContact O-CG 3.16Å; V208-R212 PolarHBondContact O-N 3.28Å; L209-R212 PolarHBondContact O-N 3.44Å
213	L	89.5	Confident	91.7	Very high	16 Å²	16	61.8 Å²	61.8	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-103.7	-2.2	-176.2	-57.8	171.2	0	0	0	112.9	L189 L209 H211 V215 Y254 I256	L189-L213 HydrophobicContact CG-CD2 4.3Å; L209-L213 HydrophobicContact CB-CD1 4.47Å; L209-L213 HydrophobicContact CD2-CD1 3.99Å; L209-L213 VanDerWaalsContact O-CB 3.26Å; L209-L213 WeakPolarHBondContact O-CB 3.43Å; L209-L213 WeakPolarHBondContact O-CG 3.47Å; L209-L213 PolarHBondContact O-N 3.16Å; H211-L213 PolarHBondContact O-N 3.4Å; L213-V215 HydrophobicContact CB-CG1 4.42Å; L213-V215 HydrophobicContact CB-CG2 4.11Å; L213-Y254 HydrophobicContact CD1-CD2 4.44Å; L213-Y254 HydrophobicContact CD1-CE2 3.68Å; L213-I256 HydrophobicContact CB-CD1 4.45Å; L213-I256 HydrophobicContact CD1-CD1 3.68Å
214	N	89.3	Confident	91.6	Very high	155 Å²	155	57.7 Å²	57.7	83%	0.829	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	50.9	-176.5	-164.3	40.7	0	0	0	113	C210	C210-N214 VanDerWaalsContact O-CA 3.31Å; C210-N214 WeakPolarHBondContact O-CA 3.18Å; C210-N214 PolarHBondContact O-N 3.16Å
215	V	90.1	Very high	91.2	Very high	20 Å²	20	59.5 Å²	59.5	12%	0.121	28%	0.282	C	S	.	.			trans	-127.6	159.7	-180	-63.2	0	0	0	0	110.9	L187 C210 L213 V220 I256	L187-V215 HydrophobicContact CD2-CG1 3.85Å; C210-V215 WeakPolarHBondContact CA-O 3.23Å; C210-V215 VanDerWaalsContact CB-O 3.23Å; C210-V215 WeakPolarHBondContact CB-O 3.39Å; C210-V215 PolarHBondContact O-N 3.43Å; C210-V215 VanDerWaalsContact O-N 3.08Å; L213-V215 HydrophobicContact CB-CG1 4.42Å; L213-V215 HydrophobicContact CB-CG2 4.11Å; V215-V220 HydrophobicContact CG2-CG2 3.44Å; V215-V220 VanDerWaalsContact CG2-CG2 3.44Å; V215-I256 HydrophobicContact CG1-CD1 4.49Å; V215-I256 HydrophobicContact CG1-CG2 4.09Å
216	E	88.9	Confident	90.7	Very high	92 Å²	92	65.1 Å²	65.1	43%	0.43	31%	0.312	S	S	.	.			trans	-82.4	153.9	-179.6	-66.6	-178.3	-136	0	0	112.6	H218 Q219 K259	E216-H218 VanDerWaalsContact CB-CE1 3.49Å; E216-H218 WeakPolarHBondContact CB-CE1 3.44Å; E216-H218 PolarHBondContact O-N 2.86Å; E216-H218 VanDerWaalsContact O-N 3.13Å; E216-H218 IonicContact OE2-CE1 3.96Å; E216-H218 PolarHBondContact OE2-CE1 3.04Å; E216-H218 IonicContact OE2-ND1 2.95Å; E216-H218 PolarHBondContact OE2-ND1 3.5Å; E216-Q219 HydrophobicContact CB-CG 4.32Å; E216-Q219 WeakPolarHBondContact O-CB 3.26Å; E216-Q219 PolarHBondContact O-N 3.01Å; E216-K259 WeakPolarHBondContact OE1-CE 3.44Å; E216-K259 IonicContact OE1-NZ 2.82Å; E216-K259 PolarHBondContact OE1-NZ 3.26Å
217	K	86.6	Confident	90.6	Very high	98 Å²	98	69.9 Å²	69.9	43%	0.426	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-49.8	-45	-177.8	-169.7	-175.9	-177.6	-154.6	0	112	R206 C210 Q219 V220 D231	R206-K217 PolarHBondContact NH2-O 3.35Å; C210-K217 VanDerWaalsContact SG-CA 3.53Å; K217-Q219 PolarHBondContact O-N 3.06Å; K217-V220 PolarHBondContact O-N 3.31Å; K217-D231 IonicContact NZ-OD2 3.35Å; K217-D231 PolarHBondContact NZ-OD2 2.98Å
218	H	87.1	Confident	90.5	Very high	119 Å²	119	70.2 Å²	70.2	55%	0.551	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.2	-176.6	69.3	-98.3	0	0	0	113.9	E216	E216-H218 VanDerWaalsContact CB-CE1 3.49Å; E216-H218 WeakPolarHBondContact CB-CE1 3.44Å; E216-H218 PolarHBondContact O-N 2.86Å; E216-H218 VanDerWaalsContact O-N 3.13Å; E216-H218 IonicContact OE2-CE1 3.96Å; E216-H218 PolarHBondContact OE2-CE1 3.04Å; E216-H218 IonicContact OE2-ND1 2.95Å; E216-H218 PolarHBondContact OE2-ND1 3.5Å
219	Q	88.8	Confident	90.4	Very high	16 Å²	16	68.1 Å²	68.1	8%	0.075	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-82.4	-26.1	179.5	-57.3	-175.6	-90.3	0	0	112.3	E216 K217 I256 K257	E216-Q219 HydrophobicContact CB-CG 4.32Å; E216-Q219 WeakPolarHBondContact O-CB 3.26Å; E216-Q219 PolarHBondContact O-N 3.01Å; K217-Q219 PolarHBondContact O-N 3.06Å; Q219-I256 HydrophobicContact CB-CG2 4.2Å; Q219-I256 CarbonylContact O-C 3.57Å; Q219-I256 VanDerWaalsContact O-CA 3.31Å; Q219-I256 WeakPolarHBondContact O-CA 3.37Å; Q219-K257 PolarHBondContact NE2-O 3.13Å; Q219-K257 PolarHBondContact O-N 3.49Å
220	V	92.3	Very high	90.3	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.3	-175.8	-176.7	0	0	0	0	110.8	R206 L209 V215 K217	R206-V220 HydrophobicContact CG-CG1 4.26Å; R206-V220 PolarHBondContact NE-O 3.11Å; R206-V220 PolarHBondContact NH2-O 3.24Å; L209-V220 HydrophobicContact CB-CG1 3.98Å; L209-V220 HydrophobicContact CB-CG2 4.48Å; L209-V220 HydrophobicContact CD1-CG1 3.67Å; L209-V220 HydrophobicContact CG-CG1 4.46Å; V215-V220 HydrophobicContact CG2-CG2 3.44Å; V215-V220 VanDerWaalsContact CG2-CG2 3.44Å; K217-V220 PolarHBondContact O-N 3.31Å
221	Q	92.7	Very high	90.2	Very high	46 Å²	46	71.9 Å²	71.9	22%	0.215	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.6	171.6	-59.2	-169.8	-46.8	0	0	109.7	F223 F228 Y254 T255 K257	Q221-F223 VanDerWaalsContact C-CE2 3.47Å; Q221-F223 HydrophobicContact CB-CE2 3.48Å; Q221-F223 VanDerWaalsContact CB-CE2 3.48Å; Q221-F223 HydrophobicContact CB-CZ 3.46Å; Q221-F223 VanDerWaalsContact CB-CZ 3.46Å; Q221-F223 VanDerWaalsContact O-CE2 3.3Å; Q221-F223 WeakPolarHBondContact O-CE2 3.16Å; Q221-F228 HydrophobicContact CB-CE1 4.25Å; Q221-F228 HydrophobicContact CG-CE1 4.43Å; Q221-Y254 CarbonylContact O-C 3.54Å; Q221-Y254 WeakPolarHBondContact O-CA 3.23Å; Q221-Y254 WeakPolarHBondContact O-CB 3.37Å; Q221-T255 PolarHBondContact N-O 3.05Å; Q221-T255 VanDerWaalsContact N-O 3.09Å; Q221-T255 PolarHBondContact O-N 3.06Å; Q221-K257 VanDerWaalsContact CD-CE 3.45Å
222	M	94.2	Very high	90	Very high	4 Å²	4	68 Å²	68	2%	0.02	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	144.2	179.9	-69.4	-169.4	71	0	0	110.7	L171 V202 L205 R206 L209 L229 L252 H253	L171-M222 HydrophobicContact CD2-CE 3.93Å; V202-M222 HydrophobicContact CG1-CB 4.01Å; V202-M222 HydrophobicContact CG1-CG 4.42Å; V202-M222 HydrophobicContact CG1-SD 3.92Å; L205-M222 HydrophobicContact CB-CE 3.92Å; L205-M222 HydrophobicContact CB-SD 3.72Å; L205-M222 HydrophobicContact CD1-CE 3.85Å; R206-M222 HydrophobicContact CG-CG 3.76Å; R206-M222 HydrophobicContact CG-SD 3.59Å; R206-M222 VanDerWaalsContact CG-SD 3.59Å; L209-M222 HydrophobicContact CD1-CE 4.43Å; L209-M222 HydrophobicContact CD1-CG 4.05Å; L209-M222 HydrophobicContact CD1-SD 3.9Å; M222-L229 HydrophobicContact CB-CD1 4.49Å; M222-L229 PolarHBondContact O-N 2.84Å; M222-L252 HydrophobicContact CE-CB 4.25Å; M222-L252 HydrophobicContact CE-CD1 3.89Å; M222-H253 CarbonylContact C-O 3.57Å; M222-H253 WeakPolarHBondContact CA-O 3.25Å
223	F	93.6	Very high	90	Very high	13 Å²	13	61.6 Å²	61.6	6%	0.057	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154.8	-170.3	-48.7	-99.7	0	0	0	111.3	Q221 E227 F228 H253 T255	Q221-F223 VanDerWaalsContact C-CE2 3.47Å; Q221-F223 HydrophobicContact CB-CE2 3.48Å; Q221-F223 VanDerWaalsContact CB-CE2 3.48Å; Q221-F223 HydrophobicContact CB-CZ 3.46Å; Q221-F223 VanDerWaalsContact CB-CZ 3.46Å; Q221-F223 VanDerWaalsContact O-CE2 3.3Å; Q221-F223 WeakPolarHBondContact O-CE2 3.16Å; F223-E227 CarbonylContact C-O 3.58Å; F223-E227 WeakPolarHBondContact CA-O 3.2Å; F223-E227 WeakPolarHBondContact CB-O 3.48Å; F223-F228 AromaticContact CD1-CD1 3.81Å; F223-F228 HydrophobicContact CD1-CD1 3.81Å; F223-F228 HydrophobicContact CD1-CE1 4.02Å; F223-F228 HydrophobicContact CD1-CG 4.09Å; F223-F228 HydrophobicContact CD1-CZ 4.45Å; F223-F228 AromaticContact CE1-CD1 3.27Å; F223-F228 HydrophobicContact CE1-CD1 3.27Å; F223-F228 HydrophobicContact CE1-CD2 4.18Å; F223-F228 AromaticContact CE1-CE1 3.03Å; F223-F228 HydrophobicContact CE1-CE1 3.03Å; F223-F228 AromaticContact CE1-CE2 3.98Å; F223-F228 HydrophobicContact CE1-CE2 3.98Å; F223-F228 AromaticContact CE1-CG 3.87Å; F223-F228 HydrophobicContact CE1-CG 3.87Å; F223-F228 AromaticContact CE1-CZ 3.42Å; F223-F228 HydrophobicContact CE1-CZ 3.42Å; F223-F228 VanDerWaalsContact CE1-CZ 3.42Å; F223-F228 AromaticContact CZ-CD1 3.87Å; F223-F228 HydrophobicContact CZ-CD1 3.87Å; F223-F228 AromaticContact CZ-CE1 3.39Å; F223-F228 HydrophobicContact CZ-CE1 3.39Å; F223-F228 HydrophobicContact CZ-CZ 4Å; F223-H253 HydrophobicContact CB-CB 4.45Å; F223-H253 PolarHBondContact N-O 3.17Å; F223-H253 PolarHBondContact O-N 3.03Å; F223-T255 HydrophobicContact CD2-CG2 4.46Å; F223-T255 HydrophobicContact CE2-CG2 3.81Å; F223-T255 VanDerWaalsContact CE2-OG1 3.25Å; F223-T255 WeakPolarHBondContact CE2-OG1 3.28Å; F223-T255 HydrophobicContact CZ-CG2 4.4Å
224	F	92.2	Very high	90.2	Very high	7 Å²	7	61 Å²	61	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.8	166.6	-178.5	-91.2	0	0	0	108.2	N226 E227 L229 H242 W243 L250 V251 L252	F224-N226 PolarHBondContact O-N 3.23Å; F224-E227 PolarHBondContact N-O 3.34Å; F224-E227 PolarHBondContact O-N 2.98Å; F224-L229 HydrophobicContact CB-CD1 4.13Å; F224-L229 HydrophobicContact CB-CD2 3.69Å; F224-L229 HydrophobicContact CB-CG 4.15Å; F224-H242 HydrophobicContact CD1-CB 3.9Å; F224-H242 AromaticContact CD1-CG 3.78Å; F224-H242 HydrophobicContact CE1-CB 3.19Å; F224-H242 AromaticContact CE1-CG 3.5Å; F224-H242 VanDerWaalsContact CE1-CG 3.5Å; F224-H242 AromaticContact CE1-ND1 3.94Å; F224-H242 HydrophobicContact CE2-CB 4.4Å; F224-H242 HydrophobicContact CZ-CB 3.48Å; F224-H242 VanDerWaalsContact CZ-CB 3.48Å; F224-W243 AromaticContact CE2-CE3 3.58Å; F224-W243 HydrophobicContact CE2-CE3 3.58Å; F224-W243 AromaticContact CE2-CZ3 3.56Å; F224-W243 HydrophobicContact CE2-CZ3 3.56Å; F224-W243 AromaticContact CZ-CE3 3.59Å; F224-W243 HydrophobicContact CZ-CE3 3.59Å; F224-W243 AromaticContact CZ-CZ3 3.67Å; F224-W243 HydrophobicContact CZ-CZ3 3.67Å; F224-L250 HydrophobicContact CD2-CD1 4.29Å; F224-L250 HydrophobicContact CE2-CD1 3.81Å; F224-V251 WeakPolarHBondContact CD2-O 3.29Å; F224-L252 HydrophobicContact CB-CD2 4.38Å; F224-L252 HydrophobicContact CD2-CD2 3.77Å; F224-L252 HydrophobicContact CG-CD2 4.48Å
225	N	86.6	Confident	90.4	Very high	107 Å²	107	53.6 Å²	53.6	57%	0.572	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	42.3	-174.8	-67.3	-5.8	0	0	0	114.3	E227	N225-E227 PolarHBondContact O-N 2.82Å
226	N	85.4	Confident	90.4	Very high	122 Å²	122	55.5 Å²	55.5	65%	0.652	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	5.5	-176	-56	-31	0	0	0	116	Q174 F224	Q174-N226 PolarHBondContact NE2-OD1 3.44Å; F224-N226 PolarHBondContact O-N 3.23Å
227	E	90.5	Very high	90.4	Very high	134 Å²	134	56 Å²	56	63%	0.626	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	141.1	172.5	-64.4	-174.3	170.8	0	0	110.9	F223 F224 N225	F223-E227 CarbonylContact C-O 3.58Å; F223-E227 WeakPolarHBondContact CA-O 3.2Å; F223-E227 WeakPolarHBondContact CB-O 3.48Å; F224-E227 PolarHBondContact N-O 3.34Å; F224-E227 PolarHBondContact O-N 2.98Å; N225-E227 PolarHBondContact O-N 2.82Å
228	F	91.3	Very high	90.6	Very high	132 Å²	132	51.3 Å²	51.3	58%	0.579	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	134.8	176.7	-74.5	-84	0	0	0	111.2	Q221 F223	Q221-F228 HydrophobicContact CB-CE1 4.25Å; Q221-F228 HydrophobicContact CG-CE1 4.43Å; F223-F228 AromaticContact CD1-CD1 3.81Å; F223-F228 HydrophobicContact CD1-CD1 3.81Å; F223-F228 HydrophobicContact CD1-CE1 4.02Å; F223-F228 HydrophobicContact CD1-CG 4.09Å; F223-F228 HydrophobicContact CD1-CZ 4.45Å; F223-F228 AromaticContact CE1-CD1 3.27Å; F223-F228 HydrophobicContact CE1-CD1 3.27Å; F223-F228 HydrophobicContact CE1-CD2 4.18Å; F223-F228 AromaticContact CE1-CE1 3.03Å; F223-F228 HydrophobicContact CE1-CE1 3.03Å; F223-F228 AromaticContact CE1-CE2 3.98Å; F223-F228 HydrophobicContact CE1-CE2 3.98Å; F223-F228 AromaticContact CE1-CG 3.87Å; F223-F228 HydrophobicContact CE1-CG 3.87Å; F223-F228 AromaticContact CE1-CZ 3.42Å; F223-F228 HydrophobicContact CE1-CZ 3.42Å; F223-F228 VanDerWaalsContact CE1-CZ 3.42Å; F223-F228 AromaticContact CZ-CD1 3.87Å; F223-F228 HydrophobicContact CZ-CD1 3.87Å; F223-F228 AromaticContact CZ-CE1 3.39Å; F223-F228 HydrophobicContact CZ-CE1 3.39Å; F223-F228 HydrophobicContact CZ-CZ 4Å
229	L	92.4	Very high	90.7	Very high	21 Å²	21	48.4 Å²	48.4	11%	0.11	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-90.3	125	174.9	-63.4	-176.9	0	0	0	111.2	V202 M222 F224 M233 L238 L252	V202-L229 HydrophobicContact CG1-CB 4.05Å; V202-L229 HydrophobicContact CG2-CB 3.9Å; V202-L229 HydrophobicContact CG2-CD1 4.21Å; M222-L229 HydrophobicContact CB-CD1 4.49Å; M222-L229 PolarHBondContact O-N 2.84Å; F224-L229 HydrophobicContact CB-CD1 4.13Å; F224-L229 HydrophobicContact CB-CD2 3.69Å; F224-L229 HydrophobicContact CB-CG 4.15Å; L229-M233 HydrophobicContact CD2-SD 4.4Å; L229-L238 HydrophobicContact CD1-CD1 4.15Å; L229-L238 HydrophobicContact CD1-CD2 4.09Å; L229-L238 HydrophobicContact CD2-CD2 3.52Å; L229-L238 HydrophobicContact CG-CD2 4.41Å; L229-L252 HydrophobicContact CD1-CD1 4.4Å; L229-L252 HydrophobicContact CD1-CD2 4.09Å
230	P	91.2	Very high	90.6	Very high	51 Å²	51	49.5 Å²	49.5	33%	0.331	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-62.4	144.5	173.1	-21.8	33	0	0	0	112.2	V202 H232 M233	V202-P230 WeakPolarHBondContact CB-O 3.36Å; V202-P230 WeakPolarHBondContact CG2-O 3.31Å; P230-H232 VanDerWaalsContact C-N 3.26Å; P230-H232 PolarHBondContact O-N 2.96Å; P230-M233 HydrophobicContact CB-CB 4.48Å; P230-M233 HydrophobicContact CG-CE 4.14Å; P230-M233 WeakPolarHBondContact O-CB 3.06Å; P230-M233 PolarHBondContact O-N 3.2Å; P230-M233 VanDerWaalsContact O-N 3.1Å
231	D	90	Very high	90.2	Very high	46 Å²	46	51.1 Å²	51.1	25%	0.246	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-36.2	-176.9	-103.1	10.7	0	0	0	113.1	V202 R203 R206 K217 M233	V202-D231 PolarHBondContact N-O 3.13Å; R203-D231 HydrophobicContact CB-CB 4.01Å; R203-D231 PolarHBondContact N-O 3.25Å; R206-D231 VanDerWaalsContact CD-OD1 3.32Å; R206-D231 WeakPolarHBondContact CD-OD1 3.3Å; R206-D231 IonicContact CZ-OD1 3.84Å; R206-D231 IonicContact NE-OD1 2.86Å; R206-D231 IonicContact NH1-OD1 3.62Å; R206-D231 PolarHBondContact NH1-OD1 2.82Å; R206-D231 IonicContact NH1-OD2 2.9Å; R206-D231 PolarHBondContact NH1-OD2 2.71Å; K217-D231 IonicContact NZ-OD2 3.35Å; K217-D231 PolarHBondContact NZ-OD2 2.98Å; D231-M233 VanDerWaalsContact C-N 3.31Å; D231-M233 PolarHBondContact O-N 2.82Å
232	H	87.1	Confident	89.9	Confident	69 Å²	69	52.1 Å²	52.1	32%	0.319	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.6	-178.1	62.3	-105.2	0	0	0	114.2	E29 E201 P230 T234	E29-H232 IonicContact OE1-CE1 3.34Å; E29-H232 IonicContact OE1-CG 2.85Å; E29-H232 IonicContact OE1-ND1 3.99Å; E29-H232 PolarHBondContact OE1-ND1 3.41Å; E201-H232 WeakPolarHBondContact OE2-CA 3.44Å; P230-H232 VanDerWaalsContact C-N 3.26Å; P230-H232 PolarHBondContact O-N 2.96Å; H232-T234 PolarHBondContact O-N 2.96Å
233	M	89.9	Confident	89.7	Confident	25 Å²	25	53.7 Å²	53.7	12%	0.123	26%	0.259	C	S	.	.			trans	-72	123.5	-175.7	-169.3	172.9	-77.6	0	0	110.4	E201 V202 L229 P230 D231 R237 L238	E201-M233 VanDerWaalsContact CA-O 3.3Å; E201-M233 WeakPolarHBondContact CA-O 3.37Å; V202-M233 HydrophobicContact CG2-CB 4.12Å; V202-M233 WeakPolarHBondContact CG2-O 3.25Å; V202-M233 PolarHBondContact N-O 2.89Å; L229-M233 HydrophobicContact CD2-SD 4.4Å; P230-M233 HydrophobicContact CB-CB 4.48Å; P230-M233 HydrophobicContact CG-CE 4.14Å; P230-M233 WeakPolarHBondContact O-CB 3.06Å; P230-M233 PolarHBondContact O-N 3.2Å; P230-M233 VanDerWaalsContact O-N 3.1Å; D231-M233 VanDerWaalsContact C-N 3.31Å; D231-M233 PolarHBondContact O-N 2.82Å; M233-R237 HydrophobicContact CG-CB 4.33Å; M233-R237 HydrophobicContact CG-CG 4.36Å; M233-L238 HydrophobicContact CG-CD1 4.44Å; M233-L238 HydrophobicContact CG-CD2 4.26Å; M233-L238 HydrophobicContact CG-CG 3.87Å; M233-L238 HydrophobicContact SD-CD1 4.47Å; M233-L238 HydrophobicContact SD-CD2 3.32Å; M233-L238 WeakPolarHBondContact SD-CD2 3.48Å; M233-L238 HydrophobicContact SD-CG 3.59Å; M233-L238 VanDerWaalsContact SD-CG 3.59Å
234	T	93.6	Very high	89.4	Confident	3 Å²	3	59 Å²	59	2%	0.018	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-79	155.2	178.8	64.4	0	0	0	0	112.4	R27 A200 E201 H232 K236 R237 L238	R27-T234 PolarHBondContact NH1-OG1 3.36Å; A200-T234 CarbonylContact O-C 3.57Å; A200-T234 VanDerWaalsContact O-CA 3.23Å; A200-T234 WeakPolarHBondContact O-CA 3.38Å; E201-T234 HydrophobicContact CG-CG2 3.92Å; H232-T234 PolarHBondContact O-N 2.96Å; T234-K236 VanDerWaalsContact C-N 3.29Å; T234-K236 PolarHBondContact O-N 3.32Å; T234-R237 PolarHBondContact O-N 3.28Å; T234-R237 VanDerWaalsContact O-N 3.13Å; T234-R237 WeakPolarHBondContact OG1-CB 3.21Å; T234-R237 PolarHBondContact OG1-N 3.42Å; T234-L238 PolarHBondContact O-N 2.83Å
235	M	93.9	Very high	89	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-36.2	177.7	-63.1	-54.4	107.9	0	0	112.3	V167 L169 V198 A200 V202 L205 R237 L238 W239 L252	V167-M235 HydrophobicContact CG1-CB 3.59Å; V167-M235 HydrophobicContact CG1-CG 4.06Å; L169-M235 HydrophobicContact CD1-CG 4.15Å; L169-M235 HydrophobicContact CD1-SD 3.63Å; L169-M235 HydrophobicContact CD2-SD 4.16Å; V198-M235 PolarHBondContact O-N 3.48Å; A200-M235 HydrophobicContact CB-CG 4.29Å; A200-M235 WeakPolarHBondContact O-CG 3.45Å; A200-M235 PolarHBondContact O-N 3.36Å; V202-M235 HydrophobicContact CG2-CE 3.9Å; L205-M235 HydrophobicContact CD1-CE 3.64Å; L205-M235 HydrophobicContact CD1-SD 3.55Å; L205-M235 VanDerWaalsContact CD1-SD 3.55Å; L205-M235 HydrophobicContact CG-CE 4.29Å; L205-M235 HydrophobicContact CG-SD 4.45Å; M235-R237 VanDerWaalsContact C-N 3.33Å; M235-R237 PolarHBondContact O-N 2.93Å; M235-L238 HydrophobicContact CE-CD1 3.61Å; M235-L238 PolarHBondContact O-N 2.93Å; M235-L238 HydrophobicContact SD-CD1 4Å; M235-W239 WeakPolarHBondContact O-CB 3.29Å; M235-W239 PolarHBondContact O-N 3.07Å; M235-L252 HydrophobicContact SD-CD1 4.28Å
236	K	90	Very high	89.1	Confident	60 Å²	60	62.5 Å²	62.5	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-43	173.5	-159.1	147.4	177.6	156.1	0	112.1	Y21 E165 V198 T234 W239 L240	Y21-K236 WeakPolarHBondContact OH-CD 3.34Å; Y21-K236 WeakPolarHBondContact OH-CE 3.27Å; Y21-K236 WeakPolarHBondContact OH-CG 3.14Å; E165-K236 IonicContact OE2-NZ 3.33Å; E165-K236 PolarHBondContact OE2-NZ 3.11Å; V198-K236 HydrophobicContact CB-CB 4.03Å; V198-K236 HydrophobicContact CB-CD 3.99Å; V198-K236 HydrophobicContact CB-CG 4.44Å; V198-K236 HydrophobicContact CG1-CD 4.49Å; V198-K236 HydrophobicContact CG2-CD 3.99Å; V198-K236 PolarHBondContact O-N 3.44Å; T234-K236 VanDerWaalsContact C-N 3.29Å; T234-K236 PolarHBondContact O-N 3.32Å; K236-W239 PolarHBondContact O-N 3.09Å; K236-L240 HydrophobicContact CG-CD1 3.92Å; K236-L240 HydrophobicContact CG-CG 4.47Å; K236-L240 WeakPolarHBondContact O-CB 3.41Å; K236-L240 VanDerWaalsContact O-CG 3.27Å; K236-L240 WeakPolarHBondContact O-CG 3.34Å; K236-L240 PolarHBondContact O-N 3.06Å
237	R	88.8	Confident	89.4	Confident	102 Å²	102	60.7 Å²	60.7	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-48	179.7	-175.2	170.4	-179.3	172.7	0	110.5	M233 T234 M235 W239 L240 S241	M233-R237 HydrophobicContact CG-CB 4.33Å; M233-R237 HydrophobicContact CG-CG 4.36Å; T234-R237 PolarHBondContact O-N 3.28Å; T234-R237 VanDerWaalsContact O-N 3.13Å; T234-R237 WeakPolarHBondContact OG1-CB 3.21Å; T234-R237 PolarHBondContact OG1-N 3.42Å; M235-R237 VanDerWaalsContact C-N 3.33Å; M235-R237 PolarHBondContact O-N 2.93Å; R237-W239 VanDerWaalsContact C-N 3.32Å; R237-W239 PolarHBondContact O-N 3.17Å; R237-L240 PolarHBondContact O-N 2.71Å; R237-S241 WeakPolarHBondContact O-CB 3.44Å; R237-S241 PolarHBondContact O-N 3.24Å; R237-S241 PolarHBondContact O-OG 3.39Å
238	L	90.9	Very high	89.4	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-55.4	-46.7	175.2	-78.8	165.3	0	0	0	112.2	V202 L229 M233 T234 M235 S241 H242 L250 L252	V202-L238 HydrophobicContact CG2-CD1 4.01Å; L229-L238 HydrophobicContact CD1-CD1 4.15Å; L229-L238 HydrophobicContact CD1-CD2 4.09Å; L229-L238 HydrophobicContact CD2-CD2 3.52Å; L229-L238 HydrophobicContact CG-CD2 4.41Å; M233-L238 HydrophobicContact CG-CD1 4.44Å; M233-L238 HydrophobicContact CG-CD2 4.26Å; M233-L238 HydrophobicContact CG-CG 3.87Å; M233-L238 HydrophobicContact SD-CD1 4.47Å; M233-L238 HydrophobicContact SD-CD2 3.32Å; M233-L238 WeakPolarHBondContact SD-CD2 3.48Å; M233-L238 HydrophobicContact SD-CG 3.59Å; M233-L238 VanDerWaalsContact SD-CG 3.59Å; T234-L238 PolarHBondContact O-N 2.83Å; M235-L238 HydrophobicContact CE-CD1 3.61Å; M235-L238 PolarHBondContact O-N 2.93Å; M235-L238 HydrophobicContact SD-CD1 4Å; L238-S241 PolarHBondContact O-N 3.38Å; L238-S241 PolarHBondContact O-OG 2.77Å; L238-H242 PolarHBondContact O-N 2.97Å; L238-L250 HydrophobicContact CB-CD2 4.01Å; L238-L252 HydrophobicContact CD1-CD1 4.38Å; L238-L252 HydrophobicContact CD1-CD2 4.48Å
239	W	89.6	Confident	89.5	Confident	57 Å²	57	56.5 Å²	56.5	22%	0.216	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-51.7	179.3	-170.4	-77.1	0	0	0	111.6	V167 M235 K236 R237 S241 W243 F244 Q248 L250	V167-W239 HydrophobicContact CG2-CD2 4.34Å; V167-W239 HydrophobicContact CG2-CE3 3.4Å; V167-W239 HydrophobicContact CG2-CZ3 3.64Å; M235-W239 WeakPolarHBondContact O-CB 3.29Å; M235-W239 PolarHBondContact O-N 3.07Å; K236-W239 PolarHBondContact O-N 3.09Å; R237-W239 VanDerWaalsContact C-N 3.32Å; R237-W239 PolarHBondContact O-N 3.17Å; W239-S241 PolarHBondContact O-N 3.44Å; W239-W243 HydrophobicContact CD2-CB 4.3Å; W239-W243 HydrophobicContact CG-CB 4.4Å; W239-W243 AromaticContact CH2-CD1 3.95Å; W239-W243 CarbonylContact O-C 3.59Å; W239-W243 VanDerWaalsContact O-CA 3.24Å; W239-W243 WeakPolarHBondContact O-CA 3.37Å; W239-W243 PolarHBondContact O-N 2.87Å; W239-F244 PolarHBondContact O-N 3.49Å; W239-Q248 HydrophobicContact CH2-CB 3.86Å; W239-L250 HydrophobicContact CE3-CB 3.67Å; W239-L250 HydrophobicContact CE3-CD2 4.27Å; W239-L250 HydrophobicContact CZ3-CB 3.65Å
240	L	86.8	Confident	89.6	Confident	39 Å²	39	55.5 Å²	55.5	20%	0.204	30%	0.297	C	S	.	.	H	α-helix	trans	-71.1	-29.5	-176.8	-65.2	170.1	0	0	0	113.2	L17 Y21 K236 R237 F244	L17-L240 HydrophobicContact CD1-CD1 3.51Å; Y21-L240 HydrophobicContact CE2-CD1 4.36Å; K236-L240 HydrophobicContact CG-CD1 3.92Å; K236-L240 HydrophobicContact CG-CG 4.47Å; K236-L240 WeakPolarHBondContact O-CB 3.41Å; K236-L240 VanDerWaalsContact O-CG 3.27Å; K236-L240 WeakPolarHBondContact O-CG 3.34Å; K236-L240 PolarHBondContact O-N 3.06Å; R237-L240 PolarHBondContact O-N 2.71Å; L240-F244 HydrophobicContact CD2-CD2 4.06Å
241	S	84.4	Confident	89.7	Confident	34 Å²	34	54.7 Å²	54.7	24%	0.238	29%	0.291	C	S	.	.	H	α-helix	trans	-79.7	-36.2	178.7	60.2	0	0	0	0	112.7	R14 R237 L238 W239	R14-S241 PolarHBondContact NH2-O 3.43Å; R237-S241 WeakPolarHBondContact O-CB 3.44Å; R237-S241 PolarHBondContact O-N 3.24Å; R237-S241 PolarHBondContact O-OG 3.39Å; L238-S241 PolarHBondContact O-N 3.38Å; L238-S241 PolarHBondContact O-OG 2.77Å; W239-S241 PolarHBondContact O-N 3.44Å
242	H	85.4	Confident	90	Very high	67 Å²	67	52.5 Å²	52.5	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-130.1	-9.4	-168.8	-55.1	-70.4	0	0	0	116.8	F224 L238 K246	F224-H242 HydrophobicContact CD1-CB 3.9Å; F224-H242 AromaticContact CD1-CG 3.78Å; F224-H242 HydrophobicContact CE1-CB 3.19Å; F224-H242 AromaticContact CE1-CG 3.5Å; F224-H242 VanDerWaalsContact CE1-CG 3.5Å; F224-H242 AromaticContact CE1-ND1 3.94Å; F224-H242 HydrophobicContact CE2-CB 4.4Å; F224-H242 HydrophobicContact CZ-CB 3.48Å; F224-H242 VanDerWaalsContact CZ-CB 3.48Å; L238-H242 PolarHBondContact O-N 2.97Å; H242-K246 PolarHBondContact O-NZ 2.81Å
243	W	89.6	Confident	90.3	Very high	38 Å²	38	51.7 Å²	51.7	14%	0.144	28%	0.276	C	S	.	.			trans	-130.2	11.5	-174.1	-139.3	-102.4	0	0	0	114	F224 W239 G245 K246 A247 L250 V251	F224-W243 AromaticContact CE2-CE3 3.58Å; F224-W243 HydrophobicContact CE2-CE3 3.58Å; F224-W243 AromaticContact CE2-CZ3 3.56Å; F224-W243 HydrophobicContact CE2-CZ3 3.56Å; F224-W243 AromaticContact CZ-CE3 3.59Å; F224-W243 HydrophobicContact CZ-CE3 3.59Å; F224-W243 AromaticContact CZ-CZ3 3.67Å; F224-W243 HydrophobicContact CZ-CZ3 3.67Å; W239-W243 HydrophobicContact CD2-CB 4.3Å; W239-W243 HydrophobicContact CG-CB 4.4Å; W239-W243 AromaticContact CH2-CD1 3.95Å; W239-W243 CarbonylContact O-C 3.59Å; W239-W243 VanDerWaalsContact O-CA 3.24Å; W239-W243 WeakPolarHBondContact O-CA 3.37Å; W239-W243 PolarHBondContact O-N 2.87Å; W243-G245 PolarHBondContact O-N 3.13Å; W243-K246 HydrophobicContact CD2-CB 4.22Å; W243-K246 HydrophobicContact CD2-CD 3.74Å; W243-K246 HydrophobicContact CE3-CD 3.87Å; W243-K246 HydrophobicContact CG-CB 4.05Å; W243-K246 HydrophobicContact CG-CD 4.19Å; W243-K246 HydrophobicContact CH2-CD 4.44Å; W243-K246 HydrophobicContact CZ2-CD 4.31Å; W243-K246 HydrophobicContact CZ3-CD 4.22Å; W243-K246 PolarHBondContact O-N 3.42Å; W243-K246 VanDerWaalsContact O-N 3.17Å; W243-A247 PolarHBondContact NE1-O 2.99Å; W243-L250 HydrophobicContact CB-CD1 3.88Å; W243-L250 HydrophobicContact CD2-CD1 3.59Å; W243-L250 HydrophobicContact CE3-CD1 3.67Å; W243-L250 HydrophobicContact CG-CB 4.3Å; W243-L250 HydrophobicContact CG-CD1 3.69Å; W243-L250 HydrophobicContact CZ3-CD1 4.41Å; W243-V251 HydrophobicContact CH2-CB 4.28Å; W243-V251 HydrophobicContact CH2-CG2 4.29Å; W243-V251 HydrophobicContact CZ2-CG2 4.23Å
244	F	88.1	Confident	90.5	Very high	124 Å²	124	50.6 Å²	50.6	54%	0.544	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	130.5	177.8	-173.5	-101.5	0	0	0	110.8	A10 W239 L240 K246	A10-F244 HydrophobicContact CB-CD1 4.42Å; A10-F244 HydrophobicContact CB-CE1 4.1Å; W239-F244 PolarHBondContact O-N 3.49Å; L240-F244 HydrophobicContact CD2-CD2 4.06Å; F244-K246 PolarHBondContact O-N 3.23Å
245	G	83.4	Confident	90.4	Very high	80 Å²	80	51 Å²	51	83%	0.825	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-1.5	-177.5	0	0	0	0	0	115.4	W243	W243-G245 PolarHBondContact O-N 3.13Å
246	K	88.8	Confident	90.2	Very high	107 Å²	107	51.7 Å²	51.7	47%	0.465	28%	0.277	S	S	.	.	S	Bend	trans	-91.9	153	174.9	-63.3	-177.3	-177.5	169.9	0	111.1	H242 W243 F244	H242-K246 PolarHBondContact O-NZ 2.81Å; W243-K246 HydrophobicContact CD2-CB 4.22Å; W243-K246 HydrophobicContact CD2-CD 3.74Å; W243-K246 HydrophobicContact CE3-CD 3.87Å; W243-K246 HydrophobicContact CG-CB 4.05Å; W243-K246 HydrophobicContact CG-CD 4.19Å; W243-K246 HydrophobicContact CH2-CD 4.44Å; W243-K246 HydrophobicContact CZ2-CD 4.31Å; W243-K246 HydrophobicContact CZ3-CD 4.22Å; W243-K246 PolarHBondContact O-N 3.42Å; W243-K246 VanDerWaalsContact O-N 3.17Å; F244-K246 PolarHBondContact O-N 3.23Å
247	A	90.9	Very high	89.9	Confident	85 Å²	85	54 Å²	54	70%	0.702	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-67.1	149	174.3	0	0	0	0	0	111.6	W243	W243-A247 PolarHBondContact NE1-O 2.99Å
248	Q	90.5	Very high	89.2	Confident	137 Å²	137	55.7 Å²	55.7	64%	0.64	30%	0.303	S	S	*	.	S	Bend	trans	-67	153.4	168	63.6	-179.1	3.2	0	0	111.2	W239	W239-Q248 HydrophobicContact CH2-CB 3.86Å
249	P	93.9	Very high	87.8	Confident	41 Å²	41	61.8 Å²	61.8	27%	0.266	33%	0.33	S	S	.	.	P	Polyproline II helix	cis	-86.8	158.4	-0.5	33.1	-32.3	0	0	0	113.9	S168 C170 F193 V251	S168-P249 WeakPolarHBondContact O-CA 3.44Å; S168-P249 WeakPolarHBondContact O-CB 3.45Å; C170-P249 HydrophobicContact CB-CB 4.46Å; C170-P249 HydrophobicContact CB-CG 4.05Å; F193-P249 HydrophobicContact CD1-CG 4.14Å; F193-P249 HydrophobicContact CE1-CG 3.87Å; P249-V251 PolarHBondContact O-N 2.91Å
250	L	93.9	Very high	85.8	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	120.1	169.4	164.5	62.9	0	0	0	109.4	S168 L169 C170 F224 L238 W239 W243 L252	S168-L250 PolarHBondContact O-N 3.21Å; L169-L250 CarbonylContact C-O 3.55Å; L169-L250 VanDerWaalsContact CA-O 3.27Å; L169-L250 WeakPolarHBondContact CA-O 3.15Å; L169-L250 HydrophobicContact CD2-CB 3.83Å; L169-L250 HydrophobicContact CD2-CD2 3.8Å; L169-L250 HydrophobicContact CD2-CG 4.02Å; C170-L250 PolarHBondContact N-O 3.32Å; F224-L250 HydrophobicContact CD2-CD1 4.29Å; F224-L250 HydrophobicContact CE2-CD1 3.81Å; L238-L250 HydrophobicContact CB-CD2 4.01Å; W239-L250 HydrophobicContact CE3-CB 3.67Å; W239-L250 HydrophobicContact CE3-CD2 4.27Å; W239-L250 HydrophobicContact CZ3-CB 3.65Å; W243-L250 HydrophobicContact CB-CD1 3.88Å; W243-L250 HydrophobicContact CD2-CD1 3.59Å; W243-L250 HydrophobicContact CE3-CD1 3.67Å; W243-L250 HydrophobicContact CG-CB 4.3Å; W243-L250 HydrophobicContact CG-CD1 3.69Å; W243-L250 HydrophobicContact CZ3-CD1 4.41Å; L250-L252 HydrophobicContact CD1-CD2 4.07Å; L250-L252 HydrophobicContact CD2-CD2 4.17Å; L250-L252 HydrophobicContact CG-CD2 3.95Å; L250-L252 HydrophobicContact CG-CG 4.31Å
251	V	94.4	Very high	83.5	Confident	34 Å²	34	75.5 Å²	75.5	21%	0.206	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.3	-178.8	-172.3	0	0	0	0	110.2	C170 E172 F224 W243 P249	C170-V251 HydrophobicContact CB-CG1 4.5Å; C170-V251 HydrophobicContact CB-CG2 4.19Å; C170-V251 WeakPolarHBondContact O-CA 3.45Å; E172-V251 HydrophobicContact CG-CG1 4.14Å; F224-V251 WeakPolarHBondContact CD2-O 3.29Å; W243-V251 HydrophobicContact CH2-CB 4.28Å; W243-V251 HydrophobicContact CH2-CG2 4.29Å; W243-V251 HydrophobicContact CZ2-CG2 4.23Å; P249-V251 PolarHBondContact O-N 2.91Å
252	L	95.3	Very high	81.2	Confident	0 Å²	0	89 Å²	89	0%	0	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	150	173.7	-54.3	-178	0	0	0	109.6	C170 L171 E172 L205 M222 F224 L229 M235 L238 L250	C170-L252 PolarHBondContact O-N 3.02Å; L171-L252 WeakPolarHBondContact CA-O 3.46Å; L171-L252 HydrophobicContact CD2-CB 3.96Å; L171-L252 HydrophobicContact CD2-CD1 4.26Å; L171-L252 HydrophobicContact CD2-CG 4.5Å; E172-L252 PolarHBondContact N-O 3.22Å; L205-L252 HydrophobicContact CD1-CD1 3.85Å; M222-L252 HydrophobicContact CE-CB 4.25Å; M222-L252 HydrophobicContact CE-CD1 3.89Å; F224-L252 HydrophobicContact CB-CD2 4.38Å; F224-L252 HydrophobicContact CD2-CD2 3.77Å; F224-L252 HydrophobicContact CG-CD2 4.48Å; L229-L252 HydrophobicContact CD1-CD1 4.4Å; L229-L252 HydrophobicContact CD1-CD2 4.09Å; M235-L252 HydrophobicContact SD-CD1 4.28Å; L238-L252 HydrophobicContact CD1-CD1 4.38Å; L238-L252 HydrophobicContact CD1-CD2 4.48Å; L250-L252 HydrophobicContact CD1-CD2 4.07Å; L250-L252 HydrophobicContact CD2-CD2 4.17Å; L250-L252 HydrophobicContact CG-CD2 3.95Å; L250-L252 HydrophobicContact CG-CG 4.31Å
253	H	94.4	Very high	81	Confident	52 Å²	52	90.1 Å²	90.1	24%	0.241	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	150.2	179.3	-59.4	87.5	0	0	0	111.3	E172 Q174 M222 F223	E172-H253 CarbonylContact O-C 3.56Å; E172-H253 WeakPolarHBondContact O-CA 3.22Å; E172-H253 IonicContact OE2-NE2 3.11Å; Q174-H253 HydrophobicContact CB-CB 4.4Å; M222-H253 CarbonylContact C-O 3.57Å; M222-H253 WeakPolarHBondContact CA-O 3.25Å; F223-H253 HydrophobicContact CB-CB 4.45Å; F223-H253 PolarHBondContact N-O 3.17Å; F223-H253 PolarHBondContact O-N 3.03Å
254	Y	93.6	Very high	80.5	Confident	1 Å²	1	92.8 Å²	92.8	0%	0.004	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.2	171	72.1	-82	0	0	0	112.4	L171 E172 R173 Q174 L189 L209 L213 Q221 I256	L171-Y254 HydrophobicContact CB-CD1 4.44Å; L171-Y254 HydrophobicContact CB-CE1 4.49Å; E172-Y254 VanDerWaalsContact C-CE1 3.47Å; E172-Y254 WeakPolarHBondContact O-CD1 3.42Å; E172-Y254 PolarHBondContact O-N 2.85Å; R173-Y254 WeakPolarHBondContact CA-O 3.43Å; R173-Y254 HydrophobicContact CB-CE1 4.07Å; R173-Y254 HydrophobicContact CB-CE2 4.2Å; R173-Y254 HydrophobicContact CG-CE2 4.2Å; Q174-Y254 PolarHBondContact N-O 2.6Å; L189-Y254 HydrophobicContact CD1-CE1 3.91Å; L189-Y254 PolarHBondContact N-OH 2.79Å; L209-Y254 HydrophobicContact CD1-CD1 4.45Å; L209-Y254 HydrophobicContact CD1-CD2 4.45Å; L209-Y254 HydrophobicContact CD1-CG 4.03Å; L209-Y254 HydrophobicContact CD2-CD1 4.06Å; L209-Y254 HydrophobicContact CD2-CD2 4.17Å; L209-Y254 HydrophobicContact CD2-CE1 4.11Å; L209-Y254 HydrophobicContact CD2-CE2 4.22Å; L209-Y254 HydrophobicContact CD2-CG 4.1Å; L213-Y254 HydrophobicContact CD1-CD2 4.44Å; L213-Y254 HydrophobicContact CD1-CE2 3.68Å; Q221-Y254 CarbonylContact O-C 3.54Å; Q221-Y254 WeakPolarHBondContact O-CA 3.23Å; Q221-Y254 WeakPolarHBondContact O-CB 3.37Å; Y254-I256 HydrophobicContact CD2-CG1 4.22Å; Y254-I256 HydrophobicContact CE2-CD1 4.23Å; Y254-I256 HydrophobicContact CE2-CG1 4.22Å
255	T	92.1	Very high	80.1	Confident	12 Å²	12	91.1 Å²	91.1	7%	0.074	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	157.9	168.6	63.5	0	0	0	0	110.3	Q174 L176 Q221 F223	Q174-T255 HydrophobicContact CB-CG2 3.76Å; L176-T255 HydrophobicContact CD1-CG2 4.49Å; Q221-T255 PolarHBondContact N-O 3.05Å; Q221-T255 VanDerWaalsContact N-O 3.09Å; Q221-T255 PolarHBondContact O-N 3.06Å; F223-T255 HydrophobicContact CD2-CG2 4.46Å; F223-T255 HydrophobicContact CE2-CG2 3.81Å; F223-T255 VanDerWaalsContact CE2-OG1 3.25Å; F223-T255 WeakPolarHBondContact CE2-OG1 3.28Å; F223-T255 HydrophobicContact CZ-CG2 4.4Å
256	I	89.2	Confident	79.9	Confident	15 Å²	15	91.7 Å²	91.7	8%	0.077	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.6	174	-54.4	178.2	0	0	0	107	L187 L213 V215 Q219 Y254	L187-I256 HydrophobicContact CB-CD1 3.79Å; L187-I256 HydrophobicContact CD1-CD1 4.44Å; L187-I256 HydrophobicContact CD1-CG2 4.4Å; L187-I256 HydrophobicContact CD2-CD1 3.86Å; L187-I256 HydrophobicContact CG-CD1 4.22Å; L213-I256 HydrophobicContact CB-CD1 4.45Å; L213-I256 HydrophobicContact CD1-CD1 3.68Å; V215-I256 HydrophobicContact CG1-CD1 4.49Å; V215-I256 HydrophobicContact CG1-CG2 4.09Å; Q219-I256 HydrophobicContact CB-CG2 4.2Å; Q219-I256 CarbonylContact O-C 3.57Å; Q219-I256 VanDerWaalsContact O-CA 3.31Å; Q219-I256 WeakPolarHBondContact O-CA 3.37Å; Y254-I256 HydrophobicContact CD2-CG1 4.22Å; Y254-I256 HydrophobicContact CE2-CD1 4.23Å; Y254-I256 HydrophobicContact CE2-CG1 4.22Å
257	K	84.8	Confident	79.4	Confident	109 Å²	109	90.8 Å²	90.8	47%	0.474	43%	0.434	S	S	.	.			trans	-81	133.2	172.6	-69.9	178.8	166.6	171.5	0	110	Q219 Q221	Q219-K257 PolarHBondContact NE2-O 3.13Å; Q219-K257 PolarHBondContact O-N 3.49Å; Q221-K257 VanDerWaalsContact CD-CE 3.45Å
258	D	72.9	Confident	78.6	Confident	136 Å²	136	91.1 Å²	91.1	73%	0.727	42%	0.416	S	S	*	.			trans	-63.1	145.2	171.6	-72.9	-37.4	0	0	0	110.6	R260	D258-R260 PolarHBondContact O-N 3.01Å
259	K	61.2	Low	77.8	Confident	130 Å²	130	87.9 Å²	87.9	57%	0.565	40%	0.4	S	S	*	.			trans	-61.1	108.8	167.7	-78.5	-171.1	172.4	-170.5	0	106.3	E216 T261	E216-K259 WeakPolarHBondContact OE1-CE 3.44Å; E216-K259 IonicContact OE1-NZ 2.82Å; E216-K259 PolarHBondContact OE1-NZ 3.26Å; K259-T261 VanDerWaalsContact C-N 3.3Å; K259-T261 PolarHBondContact O-N 2.88Å
260	R	48.8	Very low	76.5	Confident	243 Å²	243	91.5 Å²	91.5	92%	0.917	41%	0.411	S	S	*	.			trans	-61.7	100.6	164.6	-79.3	-177.1	177.1	172.7	-2.5	106.4	D258 R262	D258-R260 PolarHBondContact O-N 3.01Å; R260-R262 PolarHBondContact O-N 2.79Å; R260-R262 VanDerWaalsContact O-N 3.13Å
261	T	38.7	Very low	75.1	Confident	140 Å²	140	99.1 Å²	99.1	86%	0.859	45%	0.445	S	S	*	.			trans	-55.8	111.9	160.1	15.9	0	0	0	0	106.4	K259	K259-T261 VanDerWaalsContact C-N 3.3Å; K259-T261 PolarHBondContact O-N 2.88Å
262	R	35.4	Very low	73.3	Confident	317 Å²	317	105 Å²	105	100%	1.196	47%	0.467	S	S	*	.			trans	-75	0	158	-102.7	-174.5	175	-178.4	-1.7	108.1	R260	R260-R262 PolarHBondContact O-N 2.79Å; R260-R262 VanDerWaalsContact O-N 3.13Å

Retrieved 262 of 262 residues in 257.5 ms (Link to these results)

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